Geometry & MOs

Info

ID:	52164
PubChem CID:	12014960
Reduced:	OC3H6 (3)
Stoich.:	AB3C6 (3)
Weight, g/mol:	188.141244
ΔH_f, kcal/mol:	-168.11
Dipole, Da:	1.98
IP(EA), eV:	-9.93(1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-tert-butyl-5,5-dimethyl-1,3-dioxan-4-ol

Drug info:

PubChemData

Smile

CC(C)C1OCC(C(O1)O)(C)C

DOS

IR

Vibrations