Geometry & MOs

Info

ID:	137853
PubChem CID:	52272996
Reduced:	SO2N4C21H30 (1)
Stoich.:	AB2C4D21E30 (1)
Weight, g/mol:	366.185138
ΔH_f, kcal/mol:	-82.62
Dipole, Da:	4.47
IP(EA), eV:	-8.69(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

N-[(2S)-2-methyl-3-pyrrolidin-1-ium-1-ylpropyl]-4-(prop-2-enylsulfamoyl)benzamide

Drug info:

PubChemData

Smile

C[C@@H](CNC(=O)CCN1C=NC2=C(C1=O)C3=C(S2)CCCC3)CN4CCCC4

DOS

IR

Vibrations