Geometry & MOs

Info

ID:	194158
PubChem CID:	78491789
Reduced:	ON4C23H34 (1)
Stoich.:	AB4C23D34 (1)
Weight, g/mol:	416.237174
ΔH_f, kcal/mol:	10.7
Dipole, Da:	6.32
IP(EA), eV:	-8.26(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

N-[2-[4-(dimethylamino)phenyl]-2-pyrrolidin-1-ium-1-ylethyl]-2,4,6-trimethylbenzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1C(=O)NCC(C2=CC=C(C=C2)N(C)C)[NH+]3CC[NH+](CC3)C

DOS

IR

Vibrations