Geometry & MOs

Info

ID:	24381
PubChem CID:	609798
Reduced:	OC14H22 (1)
Stoich.:	AB14C22 (1)
Weight, g/mol:	206.167065
ΔH_f, kcal/mol:	-79.55
Dipole, Da:	3.58
IP(EA), eV:	-9.37(0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,6,8-trimethyltricyclo[5.3.1.03,8]undecan-2-one

Drug info:

PubChemData

Smile

CC1CCC2(C(=O)C3CCC2(C1C3)C)C

DOS

IR

Vibrations