Geometry & MOs

Info

ID:	216056
PubChem CID:	85085642
Reduced:	PO3C10H21 (1)
Stoich.:	AB3C10D21 (1)
Weight, g/mol:	220.109944
ΔH_f, kcal/mol:	-204.47
Dipole, Da:	1.06
IP(EA), eV:	-9.58(0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[hydroxy(phenyl)methyl]pent-3-enoate

Drug info:

PubChemData

Smile

CCCCCC=CCP(=O)(OC)OC

DOS

IR

Vibrations