Geometry & MOs

Info

ID:	413367
PubChem CID:	135086315
Reduced:	O4C7H10 (1)
Stoich.:	A4B7C10 (1)
Weight, g/mol:	266.134051
ΔH_f, kcal/mol:	-167.12
Dipole, Da:	5.34
IP(EA), eV:	-10.18(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(Z)-3,6-dimethyloct-6-enyl] thiophene-2-carboxylate

Drug info:

PubChemData

Smile

C/C=C/COC(=O)CC(=O)O

DOS

IR

Vibrations