Geometry & MOs

Info

ID:	13529
PubChem CID:	242149
Reduced:	OC7H14 (2)
Stoich.:	AB7C14 (2)
Weight, g/mol:	228.20893
ΔH_f, kcal/mol:	-147.09
Dipole, Da:	2.21
IP(EA), eV:	-9.71(2.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5-dimethyl-2-pentyl-5-propyl-1,3-dioxane

Drug info:

PubChemData

Smile

CCCCCC1(OCC(CO1)(C)CCC)C

DOS

IR

Vibrations