Geometry & MOs

Info

ID:	407942
PubChem CID:	135080697
Reduced:	NOSC4H5 (2)
Stoich.:	ABCD4E5 (2)
Weight, g/mol:	286.978214
ΔH_f, kcal/mol:	-62.1
Dipole, Da:	5.96
IP(EA), eV:	-8.55(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,1,1-trifluoro-2-[isocyanato(2,2,2-trifluoroethoxy)phosphoryl]oxyethane

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(SC(=C1)C(=S)N)N

DOS

IR

Vibrations