Geometry & MOs

Info

ID:	335834
PubChem CID:	127254696
Reduced:	OF3N3C16H18 (1)
Stoich.:	AB3C3D16E18 (1)
Weight, g/mol:	312.12224
ΔH_f, kcal/mol:	-158.57
Dipole, Da:	7.52
IP(EA), eV:	-8.78(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-imidazol-1-ylethyl)-7-methoxy-4-oxo-1H-quinoline-3-carboxamide

Drug info:

PubChemData

Smile

C1=CN(C=C1)CCCCCC(=O)NC2=NC=C(C=C2)C(F)(F)F

DOS

IR

Vibrations