Geometry & MOs

Info

ID:	27264
PubChem CID:	819992
Reduced:	ClNOC9H12 (1)
Stoich.:	ABCD9E12 (1)
Weight, g/mol:	240.020274
ΔH_f, kcal/mol:	-34.12
Dipole, Da:	2.85
IP(EA), eV:	-9.54(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-chlorophenyl)pyrazine-2,3-dicarbonitrile

Drug info:

PubChemData

Smile

CC1=CN=C(C(=C1OC)C)CCl

DOS

IR

Vibrations