Geometry & MOs

Info

ID:	237370
PubChem CID:	92718908
Reduced:	NO2C19H25 (1)
Stoich.:	AB2C19D25 (1)
Weight, g/mol:	295.132077
ΔH_f, kcal/mol:	-60.15
Dipole, Da:	2.81
IP(EA), eV:	-8.28(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[(1S)-1-amino-2-phenylethyl]-1,5-dihydro-1,5-benzodiazepine-2,4-dione

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)[C@@H](C2=C(C=CC(=C2)C)C)N)OCC

DOS

IR

Vibrations