Geometry & MOs

Info

ID:	381966
PubChem CID:	134972850
Reduced:	ClON2H11C19 (1)
Stoich.:	ABC2D11E19 (1)
Weight, g/mol:	360.982797
ΔH_f, kcal/mol:	76.9
Dipole, Da:	7.5
IP(EA), eV:	-10.03(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6-chloropyridin-3-yl)-[2-(3,4-dichlorophenyl)phenyl]methanone

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C2=CC=C(C=C2)C#N)C(=O)C3=CN=C(C=C3)Cl

DOS

IR

Vibrations