Geometry & MOs

Info

ID:	246117
PubChem CID:	103045170
Reduced:	FNO2H14C17 (1)
Stoich.:	ABC2D14E17 (1)
Weight, g/mol:	243.125929
ΔH_f, kcal/mol:	-57.59
Dipole, Da:	2.42
IP(EA), eV:	-9.46(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-1-quinolin-5-yloxypentan-2-one

Drug info:

PubChemData

Smile

C[C@H](C1=C(C=CC=C1F)OC2=CC=CC3=C2C=CC=N3)O

DOS

IR

Vibrations