Geometry & MOs

Info

ID:	134941
PubChem CID:	51786798
Reduced:	ClNO2C14H14 (2)
Stoich.:	ABC2D14E14 (2)
Weight, g/mol:	530.197235
ΔH_f, kcal/mol:	-124.72
Dipole, Da:	1.68
IP(EA), eV:	-8.66(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R)-2-(butylamino)-1-(2-methoxynaphthalen-1-yl)-2-oxoethyl]-N-(2-chlorophenyl)-4-methoxybenzamide

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)[C@H](C(=O)NC2CCCCC2)N(C3=CC=CC=C3Cl)C(=O)C4=CC=C(C=C4)Cl)O

DOS

IR

Vibrations