Geometry & MOs

Info

ID:	60715
PubChem CID:	26697492
Reduced:	SN2O4C21H26 (1)
Stoich.:	AB2C4D21E26 (1)
Weight, g/mol:	259.157229
ΔH_f, kcal/mol:	-139.74
Dipole, Da:	8.68
IP(EA), eV:	-8.37(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-4-(4-methylphenyl)-4-oxobutanamide

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3CCCC3)OC

DOS

IR

Vibrations