Geometry & MOs

Info

ID:	144948
PubChem CID:	53436330
Reduced:	ClO2H9C10 (1)
Stoich.:	AB2C9D10 (1)
Weight, g/mol:	159.102119
ΔH_f, kcal/mol:	-42.4
Dipole, Da:	4.21
IP(EA), eV:	-9.3(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

hex-3-en-1-ol;acetate

Drug info:

PubChemData

Smile

C1C=CC=CC1C2=CC(C(=O)O2)Cl

DOS

IR

Vibrations