Geometry & MOs

Info

ID:	123995
PubChem CID:	50869264
Reduced:	ClIN2C22H24 (1)
Stoich.:	ABC2D22E24 (1)
Weight, g/mol:	395.200905
ΔH_f, kcal/mol:	57.28
Dipole, Da:	4.29
IP(EA), eV:	-8.06(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(7-fluoro-2,2,4-trimethyl-1-propylquinolin-6-yl)-N-(2-methyl-4-nitrophenyl)methanimine

Drug info:

PubChemData

Smile

CCCN1C2=C(C=C(C(=C2)Cl)C=NC3=CC=CC=C3I)C(=CC1(C)C)C

DOS

IR

Vibrations