Geometry & MOs

Info

ID:	204092
PubChem CID:	79911226
Reduced:	ON2C18H30 (1)
Stoich.:	AB2C18D30 (1)
Weight, g/mol:	228.172545
ΔH_f, kcal/mol:	-49.37
Dipole, Da:	1.94
IP(EA), eV:	-7.98(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,6-dioxaspiro[4.5]decan-9-yl)pentan-2-ol

Drug info:

PubChemData

Smile

CCN(C1=CC=CC=C1C)C2(CC(OC2(C)C)(C)C)CN

DOS

IR

Vibrations