Geometry & MOs

Info

ID:	50775
PubChem CID:	12013363
Reduced:	ClNOPH25C30 (1)
Stoich.:	ABCDE25F30 (1)
Weight, g/mol:	369.128427
ΔH_f, kcal/mol:	26.64
Dipole, Da:	3.45
IP(EA), eV:	-9.25(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-3-(4-methylphenyl)-2-[(E)-2-(4-methylphenyl)ethenyl]quinoline

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=C(N=C3C=CC(=CC3=C2)Cl)C(C)P(=O)(C4=CC=CC=C4)C5=CC=CC=C5

DOS

IR

Vibrations