Geometry & MOs

Info

ID:	124297
PubChem CID:	50877414
Reduced:	N3O5C14H15 (1)
Stoich.:	A3B5C14D15 (1)
Weight, g/mol:	245.105193
ΔH_f, kcal/mol:	-98.03
Dipole, Da:	8.1
IP(EA), eV:	-9.31(-1.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,5,7-trimethylquinolin-4-yl)oxyacetic acid

Drug info:

PubChemData

Smile

CCOC(=O)C1=CN=C2C=C(C=CC2=C1NCCO)[N+](=O)[O-]

DOS

IR

Vibrations