Geometry & MOs

Info

ID:	395487
PubChem CID:	135025583
Reduced:	BrO4C10H11 (1)
Stoich.:	AB4C10D11 (1)
Weight, g/mol:	286.120509
ΔH_f, kcal/mol:	-156.99
Dipole, Da:	5.59
IP(EA), eV:	-10.84(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-O'-benzyl 2-O-methyl bicyclo[2.2.1]hept-5-ene-2,2-dicarboxylate

Drug info:

PubChemData

Smile

COC(=O)C12CC3CC1C(C3Br)OC2=O

DOS

IR

Vibrations