Geometry & MOs

Info

ID:	2253
PubChem CID:	6443
Reduced:	O2Cl3C4H7 (1)
Stoich.:	A2B3C4D7 (1)
Weight, g/mol:	191.951163
ΔH_f, kcal/mol:	-137.41
Dipole, Da:	2.71
IP(EA), eV:	-10.87(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2,3-trichlorobutane-1,1-diol

Drug info:

PubChemData

Smile

CC(C(C(O)O)(Cl)Cl)Cl

DOS

IR

Vibrations