Geometry & MOs

Info

ID:	218407
PubChem CID:	85089400
Reduced:	N3O6C24H37 (1)
Stoich.:	A3B6C24D37 (1)
Weight, g/mol:	463.225977
ΔH_f, kcal/mol:	-300.98
Dipole, Da:	7.9
IP(EA), eV:	-9.67(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(cyanomethyl)-4-methyl-2-[phenyl-(4-quinolin-3-ylphenyl)methoxy]pentanamide

Drug info:

PubChemData

Smile

CCC(CC(C(CC1=CC=CC=C1)NC(=O)CC(C(=O)O)NC(=O)C)O)C(=O)NCC(C)C

DOS

IR

Vibrations