Geometry & MOs

Info

ID:	273579
PubChem CID:	103771410
Reduced:	NCl2O2C13H17 (1)
Stoich.:	AB2C2D13E17 (1)
Weight, g/mol:	241.204179
ΔH_f, kcal/mol:	-105.82
Dipole, Da:	2.54
IP(EA), eV:	-9.9(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclopentyl-N-(2-hydroxy-4-methylpentyl)propanamide

Drug info:

PubChemData

Smile

CC(C)CC(CNC(=O)C1=C(C(=CC=C1)Cl)Cl)O

DOS

IR

Vibrations