1-Methyl-7-Nitro-5-Phenyl-3H-1,4-Benzodiazepin-2-One

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Properties Simple | Detailed

Formula C16H13N3O3
IUPAC Name 1-methyl-7-nitro-5-phenyl-3h-1,4-benzodiazepin-2-one
Molecular Mass 295.293 g·mol−1
Heat of Formation 111.0 ± 16.7 kJ·mol−1
Dipole Moment 2.43 ± 1.08 D
Volume 334.13 Å 3
Surface Area 295.8 Å 2
HOMO Energy -9.69 ± 0.55 eV
LUMO Energy 1.44 ± eV
Point Group Symmetry C1
InChIKey OMVFOGWFUGRGRL-UHFFFAOYSA-N
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