Geometry & MOs

Info

ID:	243388
PubChem CID:	99222741
Reduced:	N3O4C22H25 (1)
Stoich.:	A3B4C22D25 (1)
Weight, g/mol:	388.215078
ΔH_f, kcal/mol:	-51.81
Dipole, Da:	8.55
IP(EA), eV:	-9.44(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-amino-2-oxoethyl)-2-naphthalen-1-yl-N-[(1R)-1-(4-propylphenyl)ethyl]acetamide

Drug info:

PubChemData

Smile

CCCC1=CC=C(C=C1)[C@H](C)N(CC(=O)N)C(=O)/C=C/C2=CC(=CC=C2)[N+](=O)[O-]

DOS

IR

Vibrations