Formula |
C19H16Cl2N6O |
IUPAC Name |
n-(2-aminoethyl)-8-chloro-6-(2-chlorophenyl)-4h-[1,2,4]triazolo[1,5-a][1,4]benzodiazepine-2-carboxamide |
Molecular Mass |
415.276 g·mol−1 |
Heat of Formation |
304.9 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.37 ± 1.08 D |
Volume |
447.73 Å 3 |
Surface Area |
388.68 Å 2 |
HOMO Energy |
-9.26 ± 0.55 eV |
LUMO Energy |
-1.39 ± eV |
Point Group Symmetry |
C1
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Synonyms
|
- 1012s
- 4h-(1,2,4)triazolo(1,5-a)(1,4)benzodiazepine-2-carboxamide, n-(2-aminoethyl)-8-chloro-6-(2-chlorophenyl)-
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CAS Number(s) |
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InChIKey |
CRZHRKFDJLUMRR-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
N
O
Cl
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