Geometry & MOs

Info

ID:	337907
PubChem CID:	127258530
Reduced:	FO3C9H15 (1)
Stoich.:	AB3C9D15 (1)
Weight, g/mol:	172.109944
ΔH_f, kcal/mol:	-198.47
Dipole, Da:	2.6
IP(EA), eV:	-10.37(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(Z)-3-hydroxypent-3-en-2-yl] butanoate

Drug info:

PubChemData

Smile

CCCC(=O)OCC(C(=O)CC)F

DOS

IR

Vibrations