Geometry & MOs

Info

ID:	174057
PubChem CID:	75716078
Reduced:	N3O6C25H33 (1)
Stoich.:	A3B6C25D33 (1)
Weight, g/mol:	451.106562
ΔH_f, kcal/mol:	-171.09
Dipole, Da:	8.55
IP(EA), eV:	-9.25(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-butyl-2-[[2-(2,3-dichlorophenyl)acetyl]-methylamino]-2-(4-nitrophenyl)acetamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations