Geometry & MOs

Info

ID:	359924
PubChem CID:	127300058
Reduced:	NSO5C16H21 (1)
Stoich.:	ABC5D16E21 (1)
Weight, g/mol:	247.124215
ΔH_f, kcal/mol:	-173.49
Dipole, Da:	5.93
IP(EA), eV:	-8.63(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-dimethyl-1-(oxolan-3-ylmethylsulfonyl)pyrrolidine

Drug info:

PubChemData

Smile

C1CC(N(C1)S(=O)(=O)CC2CCOC2)C3=CC4=C(C=C3)OCO4

DOS

IR

Vibrations