Geometry & MOs

Info

ID:	62019
PubChem CID:	26717055
Reduced:	ClFO2N5H15C20 (1)
Stoich.:	ABC2D5E15F20 (1)
Weight, g/mol:	440.148455
ΔH_f, kcal/mol:	-29.04
Dipole, Da:	7.26
IP(EA), eV:	-8.42(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,4-dimethoxyphenyl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)quinoline-4-carboxamide

Drug info:

PubChemData

Smile

CC1=NN(C(=C1/C=C/C(=O)NC2=CC3=C(C=C2)NC(=O)N3)Cl)C4=CC=C(C=C4)F

DOS

IR

Vibrations