Geometry & MOs

Info

ID:	385689
PubChem CID:	134979736
Reduced:	OC11H12 (1)
Stoich.:	AB11C12 (1)
Weight, g/mol:	344.06371
ΔH_f, kcal/mol:	27.22
Dipole, Da:	3.6
IP(EA), eV:	-9.17(0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-iodo-1,11,11-trimethyl-4-tricyclo[6.2.1.02,7]undeca-2,4-dienyl)methanol

Drug info:

PubChemData

Smile

C1C(=O)C[C@@H]\2C=C[C@H]1/C=C\C=C2

DOS

IR

Vibrations