Geometry & MOs

Info

ID:	195138
PubChem CID:	78642388
Reduced:	N3O4C22H25 (1)
Stoich.:	A3B4C22D25 (1)
Weight, g/mol:	342.157957
ΔH_f, kcal/mol:	-130.76
Dipole, Da:	0.82
IP(EA), eV:	-8.64(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-nitrophenoxy)-N-(2-phenylbutyl)propanamide

Drug info:

PubChemData

Smile

CCCC1=CC=C(C=C1)C2(C(=O)N(C(=O)N2)CC(=O)NC3=CC=CC=C3OC)C

DOS

IR

Vibrations