7-Bromo-1-[2-(Diethylamino)Ethyl]-5-(2-Fluorophenyl)-1,3-Dihydro-2H-1,4-Benzodiazepin-2-One

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Properties Simple | Detailed

Formula C21H23BrFN3O
IUPAC Name 7-bromo-1-[2-(diethylamino)ethyl]-5-(2-fluorophenyl)-3h-1,4-benzodiazepin-2-one
Molecular Mass 432.329 g·mol−1
Heat of Formation -92.8 ± 16.7 kJ·mol−1
Dipole Moment 2.95 ± 1.08 D
Volume 464.95 Å 3
Surface Area 388.04 Å 2
HOMO Energy -8.78 ± 0.55 eV
LUMO Energy 2.15 ± eV
Point Group Symmetry C1
InChIKey FRXOAXNCRZNTCO-UHFFFAOYSA-N
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Elements C F H O N Br