Geometry & MOs

Info

ID:	39953
PubChem CID:	8143261
Reduced:	Cl2O2N3H15C19 (1)
Stoich.:	A2B2C3D15E19 (1)
Weight, g/mol:	379.178358
ΔH_f, kcal/mol:	5.55
Dipole, Da:	7.24
IP(EA), eV:	-9.12(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

pentyl 2-(3,4-dimethoxyphenyl)quinoline-4-carboxylate

Drug info:

PubChemData

Smile

CN(CC1=C(C=C(C=C1)Cl)Cl)CC2=NC(=O)C3=C(N2)C4=CC=CC=C4O3

DOS

IR

Vibrations