Geometry & MOs

Info

ID:	8888
PubChem CID:	83116
Reduced:	ClO2C4H8 (2)
Stoich.:	AB2C4D8 (2)
Weight, g/mol:	246.042564
ΔH_f, kcal/mol:	-207.29
Dipole, Da:	2.96
IP(EA), eV:	-10.28(0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-chloro-3-[2-(3-chloro-2-hydroxypropoxy)ethoxy]propan-2-ol

Drug info:

PubChemData

Smile

C(COCC(CCl)O)OCC(CCl)O

DOS

IR

Vibrations