Chemical ID: 6663626

c1ccc(cc1)[S-]
Chemical ID:
6663626
Name [?]:
benzenethiolate
SMILES [?]:
c1ccc(cc1)[S-]
InChi [?]:
InChI=1/C6H6S/c7-6-4-2-1-3-5-6/h1-5,7H/p-1
InChi Info:
AuxInfo=1/1/N:1,2,6,3,5,4,7/E:(2,3)(4,5)/rA:7nCCCCCCS-/rB:s1;d2;s3;d4;d1s5;s4;/rC:;;;;;;;

Chemical Details

Atom Count
Formula:C6H5S-
All Atoms:7
Heavy Atoms:7
Chiral Atoms:0
ZAP Information [?]
Total:-32.5514
Area:254.662
Solvation:-38.918
Coulombic:17.5657
Bond Count [?]
All:7
Single:4
Double:3
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:109.17
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:2.4
LogP (Chemaxon):2.13

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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