1-(4-Acetylaminophenyl)-4-Methyl-7,8-Methylenedioxy-5H-2,3-Benzodiazepine

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Properties Simple | Detailed

Formula C19H17N3O3
IUPAC Name n-[4-(8-methyl-9h-[1,3]dioxolo[4,5-h][2,3]benzodiazepin-5-yl)phenyl]acetamide
Molecular Mass 335.357 g·mol−1
Heat of Formation -110.6 ± 16.7 kJ·mol−1
Dipole Moment 1.53 ± 1.08 D
Volume 384.85 Å 3
Surface Area 344.96 Å 2
HOMO Energy -8.67 ± 0.55 eV
LUMO Energy 2.30 ± eV
Point Group Symmetry C1
InChIKey FQJHGRUTMSOBTP-UHFFFAOYSA-N
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