Geometry & MOs

Info

ID:	458
PubChem CID:	2789
Reduced:	ClN2O2H13C16 (1)
Stoich.:	AB2C2D13E16 (1)
Weight, g/mol:	300.066555
ΔH_f, kcal/mol:	-35.27
Dipole, Da:	4.54
IP(EA), eV:	-9.03(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-chloro-1-methyl-5-phenyl-1,5-benzodiazepine-2,4-dione

Drug info:

PubChemData

Smile

CN1C(=O)CC(=O)N(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3

DOS

IR

Vibrations