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

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Properties Simple | Detailed

Formula C16H12FN3O4
IUPAC Name 5-(2-fluorophenyl)-3-hydroxy-1-methyl-7-nitro-3h-1,4-benzodiazepin-2-one
Molecular Mass 329.283 g·mol−1
Heat of Formation 1911.2 ± 16.7 kJ·mol−1
Dipole Moment 1.93 ± 1.08 D
Volume 326.19 Å 3
Surface Area 292.54 Å 2
HOMO Energy -10.17 ± 0.55 eV
LUMO Energy -2.90 ± eV
Point Group Symmetry C1
InChIKey KJTUBZKMFRILQD-HNNXBMFYSA-N
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