Geometry & MOs

Info

ID:	51761
PubChem CID:	12014492
Reduced:	BrO3C12H17 (1)
Stoich.:	AB3C12D17 (1)
Weight, g/mol:	208.109944
ΔH_f, kcal/mol:	-131.58
Dipole, Da:	3.05
IP(EA), eV:	-9.4(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-methyl-5-(2-methylprop-1-enyl)furan-3-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(OC(=C1)CC(C)C)CBr

DOS

IR

Vibrations