Geometry & MOs

Info

ID:	378021
PubChem CID:	134224089
Reduced:	NCl3O3H18C25 (1)
Stoich.:	AB3C3D18E25 (1)
Weight, g/mol:	517.19026
ΔH_f, kcal/mol:	-59.35
Dipole, Da:	3.71
IP(EA), eV:	-9.22(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-7-[8-(methylideneamino)-7-[(Z)-prop-1-enyl]quinolin-2-yl]-5-(1H-1,10-phenanthrolin-2-ylidene)quinolin-8-one

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(C2=C(N1CC3=CC=C(C=C3)Cl)C=C(C=C2)Cl)C(=O)C4=CC=C(C=C4)Cl

DOS

IR

Vibrations