Geometry & MOs

Info

ID:	25109
PubChem CID:	618985
Reduced:	N3O3C15H19 (1)
Stoich.:	A3B3C15D19 (1)
Weight, g/mol:	247.084458
ΔH_f, kcal/mol:	-82.45
Dipole, Da:	3.36
IP(EA), eV:	-9.59(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,4-dimethoxyquinolin-3-yl)acetic acid

Drug info:

PubChemData

Smile

CC(C)C1(C(=O)N(C(=N1)C2=C(C=CC=N2)C(=O)OC)C)C

DOS

IR

Vibrations