Geometry & MOs

Info

ID:	174330
PubChem CID:	75753238
Reduced:	N3O6C23H29 (1)
Stoich.:	A3B6C23D29 (1)
Weight, g/mol:	480.298808
ΔH_f, kcal/mol:	-161.79
Dipole, Da:	8.66
IP(EA), eV:	-9.06(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-tert-butyl-N-[2-(cyclohexylamino)-1-(4-methoxyphenyl)-2-oxoethyl]-3-(4-methoxyphenyl)propanamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations