Geometry & MOs

Info

ID:	334301
PubChem CID:	127252853
Reduced:	NO5H23C28 (1)
Stoich.:	AB5C23D28 (1)
Weight, g/mol:	475.247107
ΔH_f, kcal/mol:	-97.87
Dipole, Da:	5.78
IP(EA), eV:	-8.25(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(7,8-dimethoxy-2-oxo-1H-3-benzazepin-3-yl)-N-[2-[1-(2-methylpropyl)indol-3-yl]ethyl]acetamide

Drug info:

PubChemData

Smile

COC1=C(C2=C(C=C1)C3=C(C4=CC=CC=C4C3=O)N(C2=O)CC5C6=CC=CC=C6CCO5)OC

DOS

IR

Vibrations