Geometry & MOs

Info

ID:	149567
PubChem CID:	53789240
Reduced:	NCl2H6C9 (2)
Stoich.:	AB2C6D9 (2)
Weight, g/mol:	385.184193
ΔH_f, kcal/mol:	59.01
Dipole, Da:	4.28
IP(EA), eV:	-9.32(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-fluoro-3-methylphenyl)-2,2,4-trimethyl-5H-chromeno[3,4-f]quinoline

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1Cl)Cl)C=C(CN2C=CN=C2)C3=C(C=C(C=C3)Cl)Cl

DOS

IR

Vibrations