Geometry & MOs

Info

ID:	343245
PubChem CID:	127266418
Reduced:	ClISN2O4C12H16 (1)
Stoich.:	ABCD2E4F12G16 (1)
Weight, g/mol:	349.086305
ΔH_f, kcal/mol:	25.2
Dipole, Da:	14.84
IP(EA), eV:	-9.22(-2.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-ethylpyrrolidin-2-yl)methyl]-4-nitrobenzenesulfonamide;hydrochloride

Drug info:

PubChemData

Smile

CC1(CN2C(S1)N(C3=CC=CC=C32)C)CI.OCl(=O)(=O)=O

DOS

IR

Vibrations