Geometry & MOs

Info

ID:	257612
PubChem CID:	103147355
Reduced:	N2O2F3C9H11 (1)
Stoich.:	A2B2C3D9E11 (1)
Weight, g/mol:	244.128629
ΔH_f, kcal/mol:	-210.25
Dipole, Da:	2.94
IP(EA), eV:	-10.35(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methoxy-4-methyl-1-(2,2,2-trifluoroethoxy)hexan-3-ol

Drug info:

PubChemData

Smile

C1=C(C=NC=N1)C(CCOCC(F)(F)F)O

DOS

IR

Vibrations