Geometry & MOs

Info

ID:	9993
PubChem CID:	95982
Reduced:	O2C13H24 (1)
Stoich.:	A2B13C24 (1)
Weight, g/mol:	212.17763
ΔH_f, kcal/mol:	-126.66
Dipole, Da:	2.8
IP(EA), eV:	-9.23(1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5,5-trimethyl-2-(4-methylpent-3-enyl)-1,3-dioxane

Drug info:

PubChemData

Smile

CC(=CCCC1(OCC(CO1)(C)C)C)C

DOS

IR

Vibrations