Geometry & MOs

Info

ID:	402700
PubChem CID:	135056941
Reduced:	OC5H6 (2)
Stoich.:	AB5C6 (2)
Weight, g/mol:	182.094294
ΔH_f, kcal/mol:	-51.21
Dipole, Da:	1.86
IP(EA), eV:	-9.17(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(E)-2-[(4Z)-4-ethylideneoxolan-3-yl]ethenyl] acetate

Drug info:

PubChemData

Smile

C1[C@H]2[C@@H]3COCC3=CC=C2CO1

DOS

IR

Vibrations