Geometry & MOs

Info

ID:	208175
PubChem CID:	80502188
Reduced:	OSN2C14H16 (1)
Stoich.:	ABC2D14E16 (1)
Weight, g/mol:	238.168128
ΔH_f, kcal/mol:	6.19
Dipole, Da:	3.7
IP(EA), eV:	-8.44(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,2-dimethylcyclohexyl)-5-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1CC(C1)(C#N)C(=O)NC2=CC(=CC=C2)SC

DOS

IR

Vibrations