Geometry & MOs

Info

ID:	303236
PubChem CID:	124489396
Reduced:	SO2N3C13H17 (1)
Stoich.:	AB2C3D13E17 (1)
Weight, g/mol:	311.130363
ΔH_f, kcal/mol:	-23.91
Dipole, Da:	5.28
IP(EA), eV:	-9.2(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-4-[(3S)-3-(methylaminomethyl)pyrrolidin-1-yl]sulfonylbenzamide

Drug info:

PubChemData

Smile

CNC[C@H]1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C#N

DOS

IR

Vibrations