Geometry & MOs

Info

ID:	25084
PubChem CID:	618830
Reduced:	NOC7H9 (2)
Stoich.:	ABC7D9 (2)
Weight, g/mol:	246.136828
ΔH_f, kcal/mol:	-52.61
Dipole, Da:	7.03
IP(EA), eV:	-9.49(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,5,6,7,9-pentamethyl-2,3-dihydro-2,3-benzodiazepine-1,4-dione

Drug info:

PubChemData

Smile

CC1=CC(=C2C(=C1C)C(C(=O)NNC2=O)(C)C)C

DOS

IR

Vibrations