Geometry & MOs

Info

ID:	25236
PubChem CID:	621149
Reduced:	NSeH9C13 (1)
Stoich.:	ABC9D13 (1)
Weight, g/mol:	294.032668
ΔH_f, kcal/mol:	72.85
Dipole, Da:	1.12
IP(EA), eV:	-8.83(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,4-dichlorophenyl)-2-(pyrrolidine-1-carbonyl)prop-2-enenitrile

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=NC3=CC=CC=C3[Se]2

DOS

IR

Vibrations