Geometry & MOs

Info

ID:	7275
PubChem CID:	71839
Reduced:	Cl3O4C7H11 (1)
Stoich.:	A3B4C7D11 (1)
Weight, g/mol:	263.972292
ΔH_f, kcal/mol:	-204.03
Dipole, Da:	2.43
IP(EA), eV:	-10.7(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-(hydroxymethyl)-2-(trichloromethyl)-1,3-dioxan-5-yl]methanol

Drug info:

PubChemData

Smile

C1C(COC(O1)C(Cl)(Cl)Cl)(CO)CO

DOS

IR

Vibrations