Geometry & MOs

Info

ID:	162110
PubChem CID:	57393648
Reduced:	N4O4C25H34 (1)
Stoich.:	A4B4C25D34 (1)
Weight, g/mol:	423.119461
ΔH_f, kcal/mol:	-125.95
Dipole, Da:	3.14
IP(EA), eV:	-8.98(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-4-oxo-N-[5-phenyl-6-(trifluoromethyl)pyridin-2-yl]quinoline-3-carboxamide

Drug info:

PubChemData

Smile

CCOC(=O)C1CCCN(C1)CC2=CN(N=N2)C3CCCCC3OC(=O)CC4=CC=CC=C4

DOS

IR

Vibrations