Geometry & MOs

Info

ID:	18326
PubChem CID:	539650
Reduced:	O2C13H22 (1)
Stoich.:	A2B13C22 (1)
Weight, g/mol:	210.16198
ΔH_f, kcal/mol:	-118.36
Dipole, Da:	4.0
IP(EA), eV:	-8.59(1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5,5,8a-tetramethyl-4a,6,7,8-tetrahydro-4H-chromen-8-ol

Drug info:

PubChemData

Smile

CC1=COC2(C(CCC(C2C1)(C)C)O)C

DOS

IR

Vibrations