Geometry & MOs

Info

ID:	136755
PubChem CID:	52094803
Reduced:	ClN2O3H17C20 (1)
Stoich.:	AB2C3D17E20 (1)
Weight, g/mol:	326.082205
ΔH_f, kcal/mol:	-38.07
Dipole, Da:	9.85
IP(EA), eV:	-8.76(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(7-chloroquinolin-4-yl)-3-methoxy-4-methylbenzamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)/C=C/C(=O)NC2=C3C=CC(=CC3=NC=C2)Cl)OC

DOS

IR

Vibrations