Geometry & MOs

Info

ID:	221048
PubChem CID:	85256618
Reduced:	FO2C16H23 (1)
Stoich.:	AB2C16D23 (1)
Weight, g/mol:	266.188195
ΔH_f, kcal/mol:	-136.73
Dipole, Da:	3.87
IP(EA), eV:	-9.57(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5-(3-oxo-2-pent-2-enylcyclopentyl)pentanoate

Drug info:

PubChemData

Smile

CCCCCC(C1C(OC1C2=CC=C(C=C2)F)C)O

DOS

IR

Vibrations