Geometry & MOs

Info

ID:	404420
PubChem CID:	135066275
Reduced:	NO5C19H27 (1)
Stoich.:	AB5C19D27 (1)
Weight, g/mol:	269.105193
ΔH_f, kcal/mol:	-211.75
Dipole, Da:	5.14
IP(EA), eV:	-8.73(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-(4-hydroxy-3-methoxyphenyl)-2,3-dihydro-1H-quinolin-4-one

Drug info:

PubChemData

Smile

CCCCCC[C@@H]1COC(=O)[C@]1(C(=O)OCC)NC2=CC=CC=C2O

DOS

IR

Vibrations