(3R)-5-(2-Chlorophenyl)-3-Methyl-7-Nitro-1,3-Dihydro-2H-1,4-Benzodiazepin-2-One

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Properties Simple | Detailed

Formula C16H12ClN3O3
IUPAC Name (3r)-5-(2-chlorophenyl)-3-methyl-7-nitro-1,3-dihydro-1,4-benzodiazepin-2-one
Molecular Mass 329.738 g·mol−1
Heat of Formation 38.7 ± 16.7 kJ·mol−1
Dipole Moment 2.73 ± 1.08 D
Volume 355.98 Å 3
Surface Area 307.34 Å 2
HOMO Energy -9.92 ± 0.55 eV
LUMO Energy -1.59 ± eV
Point Group Symmetry C1
InChIKey LMUVYJCAFWGNSY-SECBINFHSA-N
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Elements H C N O Cl