Geometry & MOs

Info

ID:	44986
PubChem CID:	10507009
Reduced:	ClSN2O6C28H29 (1)
Stoich.:	ABC2D6E28F29 (1)
Weight, g/mol:	457.194974
ΔH_f, kcal/mol:	-7.63
Dipole, Da:	14.78
IP(EA), eV:	-9.93(-2.42)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

4-[2-(2,4-diphenyl-6-propylpyridin-1-ium-1-yl)ethyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CCCC1=[N+](C(=CC(=C1)C2=CC=CC=C2)C3=CC=CC=C3)CCC4=CC=C(C=C4)S(=O)(=O)N.[O-]Cl(=O)(=O)=O

DOS

IR

Vibrations