Geometry & MOs

Info

ID:	174167
PubChem CID:	75733721
Reduced:	N3O3C26H37 (1)
Stoich.:	A3B3C26D37 (1)
Weight, g/mol:	476.223056
ΔH_f, kcal/mol:	-112.52
Dipole, Da:	0.99
IP(EA), eV:	-8.89(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(butylamino)-1-oxo-3,3-diphenylpropan-2-yl]-2-chloro-N-propylbenzamide

Drug info:

PubChemData

Smile

CCCN(C(C1=CC=C(C=C1)OC)C(=O)NC(C)(C)CC(C)(C)C)C(=O)C2=CN=CC=C2

DOS

IR

Vibrations