Geometry & MOs

Info

ID:	21012
PubChem CID:	586735
Reduced:	OC4H6 (3)
Stoich.:	AB4C6 (3)
Weight, g/mol:	210.125594
ΔH_f, kcal/mol:	-137.95
Dipole, Da:	4.24
IP(EA), eV:	-8.98(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(3-ethoxycyclohex-2-en-1-ylidene)acetate

Drug info:

PubChemData

Smile

CCOC1=CC(=CC(=O)OCC)CCC1

DOS

IR

Vibrations