Geometry & MOs

Info

ID:	45506
PubChem CID:	10514280
Reduced:	ClN3C12H20 (1)
Stoich.:	AB3C12D20 (1)
Weight, g/mol:	242.037763
ΔH_f, kcal/mol:	-25.83
Dipole, Da:	4.23
IP(EA), eV:	-8.53(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(trifluoromethoxy)-2-[2-(trifluoromethoxy)ethoxy]ethane

Drug info:

PubChemData

Smile

C1CN(CCC1[NH3+])CC2=CC(=CC=C2)N.[Cl-]

DOS

IR

Vibrations