Geometry & MOs

Info

ID:	338970
PubChem CID:	127259981
Reduced:	NSO3C21H37 (1)
Stoich.:	ABC3D21E37 (1)
Weight, g/mol:	312.114378
ΔH_f, kcal/mol:	-157.03
Dipole, Da:	3.7
IP(EA), eV:	-8.41(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzenesulfonyl (2S)-4-(dimethylamino)-1-methylpyrrolidine-2-carboxylate

Drug info:

PubChemData

Smile

CCCCCCCCC(CCC(C)OS(=O)(=O)C1=CC=CC=C1)N(C)C

DOS

IR

Vibrations