Geometry & MOs

Info

ID:	10976
PubChem CID:	109552
Reduced:	O3C13H16 (1)
Stoich.:	A3B13C16 (1)
Weight, g/mol:	220.109944
ΔH_f, kcal/mol:	-105.02
Dipole, Da:	2.96
IP(EA), eV:	-9.45(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

hex-2-enyl 2-hydroxybenzoate

Drug info:

PubChemData

Smile

CCCC=CCOC(=O)C1=CC=CC=C1O

DOS

IR

Vibrations