Geometry & MOs

Info

ID:	205229
PubChem CID:	80072572
Reduced:	NSO2C12H23 (1)
Stoich.:	ABC2D12E23 (1)
Weight, g/mol:	287.1919
ΔH_f, kcal/mol:	-97.77
Dipole, Da:	5.74
IP(EA), eV:	-9.17(0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methylpropyl)-2-(3-methylsulfonylcyclohexyl)pyrrolidine

Drug info:

PubChemData

Smile

CNCCC=CC1CCCC(C1)S(=O)(=O)C

DOS

IR

Vibrations