Geometry & MOs

Info

ID:	337354
PubChem CID:	127257039
Reduced:	SN3O4C10H15 (1)
Stoich.:	AB3C4D10E15 (1)
Weight, g/mol:	430.135114
ΔH_f, kcal/mol:	-155.77
Dipole, Da:	9.3
IP(EA), eV:	-9.4(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-phenyl-6-(1-phenylethylamino)phenyl] pyridine-3-sulfonate

Drug info:

PubChemData

Smile

CCNC(=O)CCOS(=O)(=O)C1=CN=C(C=C1)N

DOS

IR

Vibrations