Geometry & MOs

Info

ID:	264317
PubChem CID:	103453870
Reduced:	O3C11H20 (1)
Stoich.:	A3B11C20 (1)
Weight, g/mol:	244.066635
ΔH_f, kcal/mol:	-159.44
Dipole, Da:	4.1
IP(EA), eV:	-9.56(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-chloro-4-fluorophenyl)-3-hydroxyhexan-2-one

Drug info:

PubChemData

Smile

CCCC(C(=O)CCC1CCCO1)O

DOS

IR

Vibrations