Geometry & MOs

Info

ID:	174170
PubChem CID:	75734062
Reduced:	N3O4C24H31 (1)
Stoich.:	A3B4C24D31 (1)
Weight, g/mol:	382.225643
ΔH_f, kcal/mol:	-77.49
Dipole, Da:	5.25
IP(EA), eV:	-9.48(-1.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-butyl-2-(3-hydroxyphenyl)-2-[(2-phenylacetyl)-propylamino]acetamide

Drug info:

PubChemData

Smile

CCCN(C(C(C)C1=CC=CC=C1)C(=O)NC(C)(C)C)C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

DOS

IR

Vibrations