Geometry & MOs

Info

ID:	396109
PubChem CID:	135027405
Reduced:	N2C15H22 (1)
Stoich.:	A2B15C22 (1)
Weight, g/mol:	323.098
ΔH_f, kcal/mol:	13.69
Dipole, Da:	1.68
IP(EA), eV:	-8.6(0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethenyl-1-(4-methylphenyl)sulfonyl-4-phenylpyrrole

Drug info:

PubChemData

Smile

CN1CCC2=C3C1C[C@@H](CC3=CC=C2)N(C)C

DOS

IR

Vibrations