Geometry & MOs

Info

ID:	387721
PubChem CID:	134986586
Reduced:	SeO3C11H14 (1)
Stoich.:	AB3C11D14 (1)
Weight, g/mol:	192.078644
ΔH_f, kcal/mol:	-103.05
Dipole, Da:	1.34
IP(EA), eV:	-8.83(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,9R)-1,8-dimethyl-10,11,12-trioxatricyclo[7.2.1.02,7]dodeca-2,4,6-triene

Drug info:

PubChemData

Smile

CCOC(=O)C(OC)[Se]C1=CC=CC=C1

DOS

IR

Vibrations