Ethyl 7-(~123~I)Iodo-5-Methyl-6-Oxo-5,6-Dihydro-4H-Imidazo[1,5-A][1,4]Benzodiazepine-3-Carboxylate

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Formula C15H14IN3O3
IUPAC Name ethyl 7-(123i)iodanyl-5-methyl-6-oxo-4h-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate
Molecular Mass 407.196 g·mol−1
Heat of Formation -170.1 ± 16.7 kJ·mol−1
Dipole Moment 4.04 ± 1.08 D
Volume 368.49 Å 3
Surface Area 322.28 Å 2
HOMO Energy -9.01 ± 0.55 eV
LUMO Energy 1.76 ± eV
Point Group Symmetry C1
Synonyms
  • 4h-imidazo(1,5-a)(1,4)benzodiazepine-3-carboxylic acid, 5,6-dihydro-7-(iodo-123i)-5-methyl-6-oxo-, ethyl ester
  • [123i]imz
  • [123i]iomazenil
  • benzodine
  • d02283
  • ethyl 5,6-dihydro-7-iodo-(sup 123)i-5-methyl-6-oxo-4h-imidazo(1,5-a)(1,4)benzodiazepine-3-carboxylate
  • iomazenil
  • iomazenil (123i)
  • iomazenil (123i) (jan)
CAS Number(s)
  • 127396-36-5
InChIKey FRIZVHMAECRUBR-KIWWSDKQSA-N
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