Geometry & MOs

Info

ID:	298166
PubChem CID:	117647873
Reduced:	O5C17H30 (1)
Stoich.:	A5B17C30 (1)
Weight, g/mol:	288.193674
ΔH_f, kcal/mol:	-286.19
Dipole, Da:	2.14
IP(EA), eV:	-10.12(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-dimethylpentan-3-yl 2-(5-hydroxy-2,2-dimethyl-1,3-dioxan-5-yl)acetate

Drug info:

PubChemData

Smile

CC1CC(CC(C1)(C)C)OC(=O)CC2(COC(OC2)(C)C)O

DOS

IR

Vibrations