Geometry & MOs

Info

ID:	358095
PubChem CID:	127295640
Reduced:	SN2O2C11H22 (1)
Stoich.:	AB2C2D11E22 (1)
Weight, g/mol:	288.187149
ΔH_f, kcal/mol:	-97.97
Dipole, Da:	3.69
IP(EA), eV:	-8.58(1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-methylpropylsulfonyl)-3-pyrrolidin-1-ylazepane

Drug info:

PubChemData

Smile

CS(=O)(=O)N1CCCCC(C1)N2CCCC2

DOS

IR

Vibrations