Formula |
C16H14N6O3S |
IUPAC Name |
[4-[[4-cyano-n-(1,2,4-triazol-4-yl)anilino]methyl]phenyl] sulfamate |
Molecular Mass |
370.386 g·mol−1 |
Heat of Formation |
174.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
8.98 ± 1.08 D |
Volume |
408.11 Å 3 |
Surface Area |
350.85 Å 2 |
HOMO Energy |
-9.90 ± 0.55 eV |
LUMO Energy |
-1.59 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 4-[(4-o-sulfamoylbenzyl)(4-cyanophenyl)amino]-4h-[1,2,4]-triazole
- 4tz
- [4-[[(4-cyanophenyl)-(1,2,4-triazol-4-yl)amino]methyl]phenyl] sulfamate
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InChIKey |
WEXGHQDVDVWOIU-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
S
C
O
N
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