Geometry & MOs

Info

ID:	171572
PubChem CID:	75395370
Reduced:	OSN3C15H17 (1)
Stoich.:	ABC3D15E17 (1)
Weight, g/mol:	393.168856
ΔH_f, kcal/mol:	26.7
Dipole, Da:	5.82
IP(EA), eV:	-9.07(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[3-(7-methoxy-2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl)phenyl]methyl]imidazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=NC(=NC=C1)C(C2CC2)NC(=O)C3=CSC=C3C

DOS

IR

Vibrations