Geometry & MOs

Info

ID:	264319
PubChem CID:	103453890
Reduced:	FOC6H7 (2)
Stoich.:	ABC6D7 (2)
Weight, g/mol:	237.136493
ΔH_f, kcal/mol:	-176.07
Dipole, Da:	1.71
IP(EA), eV:	-10.07(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-hydroxy-1-(5-propoxypyridin-3-yl)pentan-1-one

Drug info:

PubChemData

Smile

CCCC(C(=O)CC1=CC(=CC(=C1)F)F)O

DOS

IR

Vibrations