Geometry & MOs

Info

ID:	392846
PubChem CID:	135018173
Reduced:	O5C21H22 (1)
Stoich.:	A5B21C22 (1)
Weight, g/mol:	206.203451
ΔH_f, kcal/mol:	-154.53
Dipole, Da:	5.62
IP(EA), eV:	-8.99(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5,6,8-tetramethyltricyclo[6.3.0.01,5]undecane

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2=CC(=C(C(=C2)C(=O)OC)C(=O)OC)CCC=C

DOS

IR

Vibrations