Standard Article

Dipole Moments of Compounds Containing Double Bonds

Double-bonded Functional Groups (1997)

  1. Otto Exner

Published Online: 15 DEC 2009

DOI: 10.1002/9780470682531.pat0123

Patai's Chemistry of Functional Groups

Patai's Chemistry of Functional Groups

How to Cite

Exner, O. 2009. Dipole Moments of Compounds Containing Double Bonds. Patai's Chemistry of Functional Groups. .

Author Information

  1. Academy of Sciences of the Czech Republic, Institute of Organic Chemistry and Biochemistry, Prague, Czech Republic

Publication History

  1. Published Online: 15 DEC 2009

Abstract

  • 1
    Introduction
  • 2
    Progress in the Dipole Moment Method
  • 3
    C[DOUBLE BOND]C Bonds
  • 4
    C[DOUBLE BOND]N Bonds
  • 5
    C[DOUBLE BOND]O Bonds
  • 6
    C[DOUBLE BOND]S Bonds
  • 7
    C[DOUBLE BOND]P Bonds
  • 8
    Other Double Bonds

Keywords:

  • dipole moments of compounds containing double bonds;
  • dipole moments of solutes and reaction-field theory;
  • progress in dipole moment method;
  • C[BOND]C bond and dipole moments;
  • dipole moment of carbonyl compound;
  • conjugated and cumulated systems;
  • cumulated C[BOND]C bonds and carbonyl group;
  • phosphorus compound chemistry and dipole moments

Featured Compounds

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  1. 1 - 143
Compound 1a
Molecular Weight:198.2206
Molecular Formula:C12H10N2O
InChIKey:GAUZCKBSTZFWCT-YPKPFQOOSA-N
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Compound 1b
Molecular Weight:198.2206
Molecular Formula:C12H10N2O
InChIKey:GAUZCKBSTZFWCT-YPKPFQOOSA-N
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Compound 1c
Molecular Weight:198.2206
Molecular Formula:C12H10N2O
InChIKey:GAUZCKBSTZFWCT-YPKPFQOOSA-N
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Compound 2a
Molecular Weight:267.111
Molecular Formula:C12H8Cl2N2O
InChIKey:NMAZIJPSESMWSA-NXVVXOECSA-N
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Compound 3a
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 4
Molecular Weight:52.0746
Molecular Formula:C4H4
InChIKey:GOSMMPKSWSOPRZ-UHFFFAOYSA-N
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Compound 5
Molecular Weight:78.1118
Molecular Formula:C6H6
InChIKey:PGTKVMVZBBZCKQ-UHFFFAOYSA-N
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Compound 6
Molecular Weight:104.1491
Molecular Formula:C8H8
InChIKey:GGKMDDDYCSVHMU-UHFFFAOYSA-N
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Compound 7
Molecular Weight:180.2451
Molecular Formula:C14H12
InChIKey:KIJLBJAMTGNATM-UHFFFAOYSA-N
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Compound 8a
Molecular Weight:198.732
Molecular Formula:C12H19Cl
InChIKey:GESYCWORANPBCO-KTKRTIGZSA-N
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Compound 8b
Molecular Weight:198.732
Molecular Formula:C12H19Cl
InChIKey:GESYCWORANPBCO-KTKRTIGZSA-N
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Compound 9a
Molecular Weight:174.711
Molecular Formula:C10H19Cl
InChIKey:FDPAXNXIDKRTKI-FPLPWBNLSA-N
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Compound 9b
Molecular Weight:174.711
Molecular Formula:C10H19Cl
InChIKey:FDPAXNXIDKRTKI-BQYQJAHWSA-N
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Compound 10a
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 10b
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 11
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 12
Molecular Weight:Not Available
Molecular Formula:(C2H2)nC4H8N2O2
InChIKey:FZNPOSVPEAZERM-UHFFFAOYSA-N
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Compound 14
Molecular Weight:126.969
Molecular Formula:C3H4Cl2O
InChIKey:NEVFFIFQMFBOEA-UHFFFAOYSA-N
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Compound 15
Molecular Weight:169.049
Molecular Formula:C6H10Cl2O
InChIKey:HJQROJGIBMNVIP-UHFFFAOYSA-N
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Compound 16a
Molecular Weight:83.0886
Molecular Formula:C4H5NO
InChIKey:IPCRTSDORDQHRO-RQOWECAXSA-N
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Compound 17a
Molecular Weight:83.0886
Molecular Formula:C4H5NO
InChIKey:IPCRTSDORDQHRO-DUXPYHPUSA-N
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Compound 18
Molecular Weight:165.2753
Molecular Formula:C11H19N
InChIKey:KPVMGWQGPJULFL-UHFFFAOYSA-N
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Compound 19a
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 19b
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 20
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 21
Molecular Weight:210.2744
Molecular Formula:C14H14N2
InChIKey:WFJMIULOCVZAIS-LFIBNONCSA-N
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Compound 22
Molecular Weight:83.0126
Molecular Formula:CF3N
InChIKey:YUWNYCDUOYZSAT-UHFFFAOYSA-N
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Compound 23
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 23a
Molecular Weight:162.2316
Molecular Formula:C10H14N2
InChIKey:QAUJTDOEDJGXEJ-ZHACJKMWSA-N
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Compound 23b
Molecular Weight:162.2316
Molecular Formula:C10H14N2
InChIKey:QAUJTDOEDJGXEJ-UHFFFAOYSA-N
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Compound 24a
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 24c
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 41
Molecular Weight:193.2025
Molecular Formula:C9H11N3O2
InChIKey:PMTHDJIMSQLFBM-UHFFFAOYSA-N
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Compound 25a
Molecular Weight:197.2325
Molecular Formula:C13H11NO
InChIKey:DNYZBFWKVMKMRM-UHFFFAOYSA-N
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Compound 25b
Molecular Weight:197.2325
Molecular Formula:C13H11NO
InChIKey:DNYZBFWKVMKMRM-UHFFFAOYSA-N
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Compound 26
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 27
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 28a
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 28b
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 28c
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 29a
Molecular Weight:363.451
Molecular Formula:C26H21NO
InChIKey:XALKZBRZSFSNIM-SZXQPVLSSA-N
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Compound 29b
Molecular Weight:363.451
Molecular Formula:C26H21NO
InChIKey:XALKZBRZSFSNIM-MEFGMAGPSA-N
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Compound 29c
Molecular Weight:363.451
Molecular Formula:C26H21NO
InChIKey:QCNLDRPNZVBELI-MEFGMAGPSA-N
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Compound 31a
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 31c
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 32a
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 32b
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 33a
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 33b
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 34
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 35
Molecular Weight:238.1968
Molecular Formula:C10H10N2O5
InChIKey:VLOAZMRXFFUHIW-XFFZJAGNSA-N
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Compound 36a
Molecular Weight:181.255
Molecular Formula:C9H11NOS
InChIKey:CNMMNRZTQRZSAI-KTKRTIGZSA-N
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Compound 36b
Molecular Weight:181.255
Molecular Formula:C9H11NOS
InChIKey:CNMMNRZTQRZSAI-MDZDMXLPSA-N
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Compound 37a
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 37c
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 38
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 39c
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 40
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 39a
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 42
Molecular Weight:195.1754
Molecular Formula:C8H9N3O3
InChIKey:IAFMFYRHNKYSMU-UHFFFAOYSA-N
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Compound 43a
Molecular Weight:207.2689
Molecular Formula:C12H17NO2
InChIKey:WVQQDGYXHFBVOM-ACCUITESSA-N
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Compound 43b
Molecular Weight:207.2689
Molecular Formula:C12H17NO2
InChIKey:WVQQDGYXHFBVOM-ACCUITESSA-N
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Compound 44
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 45
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 46
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 46a
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 47
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 49
Molecular Weight:122.1644
Molecular Formula:C8H10O
InChIKey:YKDJBIPPVNMAGR-UHFFFAOYSA-N
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Compound 50a
Molecular Weight:136.1479
Molecular Formula:C8H8O2
InChIKey:OVELCYAYFLVITA-UHFFFAOYSA-N
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Compound 51
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 52
Molecular Weight:233.2646
Molecular Formula:C16H11NO
InChIKey:VOMBBXQRJHALLY-RVDMUPIBSA-N
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Compound 53
Molecular Weight:247.2912
Molecular Formula:C17H13NO
InChIKey:LOMVIEJUNMFYQX-LFIBNONCSA-N
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Compound 54
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 55
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 56
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 57
Molecular Weight:66.0581
Molecular Formula:C4H2O
InChIKey:UMAVDYRKRNTEEM-UHFFFAOYSA-N
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Compound 58
Molecular Weight:92.0954
Molecular Formula:C6H4O
InChIKey:TYMWDZKTHYZJBV-UHFFFAOYSA-N
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Compound 59
Molecular Weight:118.1326
Molecular Formula:C8H6O
InChIKey:ZRIOAGONWOHVCT-UHFFFAOYSA-N
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Compound 60
Molecular Weight:160.1693
Molecular Formula:C10H8O2
InChIKey:BUGIEHXRMMWPNE-UHFFFAOYSA-N
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Compound 61
Molecular Weight:160.1693
Molecular Formula:C10H8O2
InChIKey:LQPQELCZNWNSBB-UHFFFAOYSA-N
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Compound 62a
Molecular Weight:225.2426
Molecular Formula:C14H11NO2
InChIKey:OLBYFEGTUWWPTR-FYWRMAATSA-N
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Compound 62b
Molecular Weight:225.2426
Molecular Formula:C14H11NO2
InChIKey:OLBYFEGTUWWPTR-SQFISAMPSA-N
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Compound 63
Molecular Weight:Not Available
Molecular Formula:(C)nCH2O
InChIKey:CCGKOQOJPYTBIH-UHFFFAOYSA-N
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Compound 64
Molecular Weight:110.927
Molecular Formula:C2Cl2O
InChIKey:TVWWMKZMZALOFP-UHFFFAOYSA-N
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Compound 65
Molecular Weight:76.482
Molecular Formula:C2HClO
InChIKey:WGZNOUWVAIGKDI-UHFFFAOYSA-N
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Compound 66
Molecular Weight:52.0315
Molecular Formula:C3O
InChIKey:TURAMGVWNUTQKH-UHFFFAOYSA-N
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Compound 67
Molecular Weight:92.0523
Molecular Formula:C5O2
InChIKey:BKMBQDLZBSCFGV-UHFFFAOYSA-N
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Compound 68
Molecular Weight:84.0734
Molecular Formula:C4H4O2
InChIKey:BWRFQFVRMJWEQW-UHFFFAOYSA-N
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Compound 69a
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 69b
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 70
Molecular Weight:76.0514
Molecular Formula:C2H4O3
InChIKey:AEMRFAOFKBGASW-UHFFFAOYSA-N
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Compound 71
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 72
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 73
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 74
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 75a
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 76a
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 77
Molecular Weight:190.212
Molecular Formula:C2F2O2S3
InChIKey:ZKVZNGXYBASQKY-UHFFFAOYSA-N
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Compound 78a
Molecular Weight:149.1897
Molecular Formula:C9H11NO
InChIKey:IMNDHOCGZLYMRO-UHFFFAOYSA-N
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Compound 78b
Molecular Weight:149.1897
Molecular Formula:C9H11NO
InChIKey:IMNDHOCGZLYMRO-UHFFFAOYSA-N
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Compound 79
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 80
Molecular Weight:110.1139
Molecular Formula:C5H6N2O
InChIKey:PGFTUYZICNEFJQ-UHFFFAOYSA-N
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Compound 81a
Molecular Weight:342.4336
Molecular Formula:C23H22N2O
InChIKey:IEJPWSWEYCOEJK-WCWDXBQESA-N
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Compound 82
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 83
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 84a
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 85
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 86a
Molecular Weight:69.062
Molecular Formula:C3H3NO
InChIKey:WARQUFORVQESFF-UHFFFAOYSA-N
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Compound 87a
Molecular Weight:94.017
Molecular Formula:C2F2O2
InChIKey:HXQOOYKLTKQCRR-UHFFFAOYSA-N
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Compound 88a
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 89
Molecular Weight:Not Available
Molecular Formula:(C)nCH2S
InChIKey:CWMKZYCJCZVSHO-UHFFFAOYSA-N
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Compound 90
Molecular Weight:68.097
Molecular Formula:C3S
InChIKey:YUYXFAJNLSCPNK-UHFFFAOYSA-N
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Compound 91
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 92a
Molecular Weight:158.218
Molecular Formula:C7H10O2S
InChIKey:SQZLQALQHNKXQP-UHFFFAOYSA-N
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Compound 92b
Molecular Weight:158.218
Molecular Formula:C7H10O2S
InChIKey:SQZLQALQHNKXQP-UHFFFAOYSA-N
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Compound 93
Molecular Weight:132.181
Molecular Formula:C5H8O2S
InChIKey:CPOPDILWICGKMG-UHFFFAOYSA-N
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Compound 94a
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 94b
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 95a
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 95b
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 96
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 97
Molecular Weight:155.217
Molecular Formula:C7H9NOS
InChIKey:UDSWAGPMYAKANV-UHFFFAOYSA-N
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Compound 98
Molecular Weight:192.281
Molecular Formula:C10H12N2S
InChIKey:YGFQVWXZMGZRJC-DHZHZOJOSA-N
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Compound 99
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 100
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 101
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 102
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 103
Molecular Weight:320.426
Molecular Formula:C16H16O3S2
InChIKey:ONOUTEUZQREROO-UHFFFAOYSA-N
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Compound 104
Molecular Weight:62.091
Molecular Formula:CH2OS
InChIKey:IWOKCMBOJXYDEE-UHFFFAOYSA-N
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Compound 105a
Molecular Weight:165.172
Molecular Formula:C9H12NP
InChIKey:VIFJQNZWJNSJQY-UHFFFAOYSA-N
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Compound 105b
Molecular Weight:165.172
Molecular Formula:C9H12NP
InChIKey:VIFJQNZWJNSJQY-UHFFFAOYSA-N
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Compound 106
Molecular Weight:266.3911
Molecular Formula:C14H23OPSi
InChIKey:LTRWUFXHWOEFFR-UHFFFAOYSA-N
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Compound 107a
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 107b
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 107c
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 108
Molecular Weight:242.2732
Molecular Formula:C14H14N2O2
InChIKey:ICHNIWWYEHETFJ-FOCLMDBBSA-N
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Compound 111
Molecular Weight:118.0913
Molecular Formula:C3H6N2O3
InChIKey:MYRROMXOABKDLG-UHFFFAOYSA-N
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Compound 112
Molecular Weight:139.175
Molecular Formula:C6H5NOS
InChIKey:FIOJWGRGPONADF-UHFFFAOYSA-N
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Compound 113
Molecular Weight:281.48
Molecular Formula:C15H23NS2
InChIKey:QAWDGSKVUKXSDC-UHFFFAOYSA-N
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Compound 114
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 115a
Molecular Weight:94.0495
Molecular Formula:C2H7O2P
InChIKey:SZZFZADQWWRRTI-UHFFFAOYSA-N
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Compound 116a
Molecular Weight:186.1449
Molecular Formula:C8H11O3P
InChIKey:OXDOANYFRLHSML-UHFFFAOYSA-N
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Compound 117
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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