Geometry & MOs

Info

ID:	395322
PubChem CID:	135025196
Reduced:	SeC7H12 (1)
Stoich.:	AB7C12 (1)
Weight, g/mol:	332.162374
ΔH_f, kcal/mol:	3.19
Dipole, Da:	3.88
IP(EA), eV:	-8.12(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl 3-benzoyl-4,4-dimethylcyclohexane-1,1-dicarboxylate

Drug info:

PubChemData

Smile

C[C@H]1CCCCC1=[Se]

DOS

IR

Vibrations