Sarmazenil

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Properties Simple | Detailed

Formula C15H14ClN3O3
IUPAC Name ethyl 7-chloro-5-methyl-6-oxo-4h-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate
Molecular Mass 319.743 g·mol−1
Heat of Formation -289.1 ± 16.7 kJ·mol−1
Dipole Moment 3.94 ± 1.08 D
Volume 348.39 Å 3
Surface Area 310.75 Å 2
HOMO Energy -9.65 ± 0.55 eV
LUMO Energy 1.71 ± eV
Point Group Symmetry C1
Synonyms
  • 7-chloro-5-methyl-6-oxo-4h-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid ethyl ester
  • 7-chloro-6-keto-5-methyl-4h-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid ethyl ester
  • ethyl 7-chloro-5,6-dihydro-5-methyl-6-oxo-4h-imidazo-(1,5-a)(1,4)benzodiazepine-3-carboxylate
CAS Number(s)
  • 78771-13-8
InChIKey WSDBAFQWNWJTNG-UHFFFAOYSA-N
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