Geometry & MOs

Info

ID:	21213
PubChem CID:	587690
Reduced:	O2C15H26 (1)
Stoich.:	A2B15C26 (1)
Weight, g/mol:	238.19328
ΔH_f, kcal/mol:	-132.77
Dipole, Da:	1.64
IP(EA), eV:	-9.32(2.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2,6,9-tetramethyl-12-oxatricyclo[7.2.1.01,6]dodecan-11-ol

Drug info:

PubChemData

Smile

CC1(CCCC2(C13C(CC(O3)(CC2)C)O)C)C

DOS

IR

Vibrations