Geometry & MOs

Info

ID:	385265
PubChem CID:	134978641
Reduced:	CH2 (16)
Stoich.:	AB2 (16)
Weight, g/mol:	210.16198
ΔH_f, kcal/mol:	-64.41
Dipole, Da:	0.41
IP(EA), eV:	-9.13(1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,5R,8S,9R)-9-methyltricyclo[6.3.1.01,5]dodecane-8,9-diol

Drug info:

PubChemData

Smile

CCCCCC/C=C(/CC)\CCCCCC

DOS

IR

Vibrations