Geometry & MOs

Info

ID:	354956
PubChem CID:	127287817
Reduced:	SO3N4C13H16 (1)
Stoich.:	AB3C4D13E16 (1)
Weight, g/mol:	238.168128
ΔH_f, kcal/mol:	-92.4
Dipole, Da:	5.43
IP(EA), eV:	-9.07(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-(4-ethylcyclohexyl)-5-oxopyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

C1CC(N(C1)C(=O)[C@H]2CCC(=O)N2)C(=O)NC3=NC=CS3

DOS

IR

Vibrations