(2Z)-7-Chloro-2-Imino-5-Phenyl-2,3-Dihydro-4H-1,4-Benzodiazepin-4-Ol

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Properties Simple | Detailed

Formula C15H12ClN3O
IUPAC Name 7-chloro-4-hydroxy-5-phenyl-3h-1,4-benzodiazepin-2-imine
Molecular Mass 285.728 g·mol−1
Heat of Formation 357.2 ± 16.7 kJ·mol−1
Dipole Moment 3.38 ± 1.08 D
Volume 321.53 Å 3
Surface Area 282.29 Å 2
HOMO Energy -8.59 ± 0.55 eV
LUMO Energy -1.83 ± eV
Point Group Symmetry C1
InChIKey IRKXPJJKXBMOMW-VKAVYKQESA-N
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Elements H C N O Cl