Formula |
C10H10N2O4S |
IUPAC Name |
2-[(2-carbamoylsulfanylacetyl)amino]benzoic acid |
Molecular Mass |
254.262 g·mol−1 |
Heat of Formation |
-635.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
1.07 ± 1.08 D |
Volume |
271.12 Å 3 |
Surface Area |
260.99 Å 2 |
HOMO Energy |
-9.25 ± 0.55 eV |
LUMO Energy |
-1.20 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 2-(2-aminocarbonylsulfanylethanoylamino)benzoic acid
- 2-[[2-(carbamoylthio)-1-oxoethyl]amino]benzoic acid
- 2-[[2-(carbamoylthio)acetyl]amino]benzoic acid
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CAS Number(s) |
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InChIKey |
NWUAPELPCMQTDN-UHFFFAOYSA-N |
QR Code |
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Links |
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DOI |
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Downloads |
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Elements |
H
C
S
O
N
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