Geometry & MOs

Info

ID:	396452
PubChem CID:	135028435
Reduced:	SO2N3H21C23 (1)
Stoich.:	AB2C3D21E23 (1)
Weight, g/mol:	301.088498
ΔH_f, kcal/mol:	58.94
Dipole, Da:	8.65
IP(EA), eV:	-9.43(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-ethenyl-1-methylsulfonyl-2-phenylpyrrolidine-3,3-dicarbonitrile

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N2C(CC(C2C=CC3=CC=CC=C3)(C#N)C#N)C=C

DOS

IR

Vibrations