Geometry & MOs

Info

ID:	350109
PubChem CID:	127277187
Reduced:	NSO2C10H21 (1)
Stoich.:	ABC2D10E21 (1)
Weight, g/mol:	261.139865
ΔH_f, kcal/mol:	-119.32
Dipole, Da:	4.39
IP(EA), eV:	-9.41(0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-1-(oxan-2-ylmethylsulfonyl)pyrrolidine

Drug info:

PubChemData

Smile

CCC1CCCN1S(=O)(=O)CC(C)C

DOS

IR

Vibrations