Geometry & MOs

Info

ID:	11144
PubChem CID:	111465
Reduced:	Cl2O3C13H26 (1)
Stoich.:	A2B3C13D26 (1)
Weight, g/mol:	300.1259
ΔH_f, kcal/mol:	-193.45
Dipole, Da:	3.05
IP(EA), eV:	-9.84(0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-chloro-3-[1-chloro-3-(2-ethylpentoxy)propan-2-yl]oxypropan-2-ol

Drug info:

PubChemData

Smile

CCCC(CC)COCC(CCl)OCC(CCl)O

DOS

IR

Vibrations