Geometry & MOs

Info

ID:	434210
PubChem CID:	135174439
Reduced:	FPSO5N6C9H12 (1)
Stoich.:	ABCD5E6F9G12 (1)
Weight, g/mol:	332.034428
ΔH_f, kcal/mol:	-228.56
Dipole, Da:	9.29
IP(EA), eV:	-9.68(-1.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[5-(dihydroxyphosphinothioyloxymethyl)oxolan-2-yl]-1H-imidazo[2,1-f][1,2,4]triazin-4-one

Drug info:

PubChemData

Smile

C1[C@@H](C(OC1N2C3=NC(=NC(=O)C3=NN2)N)COP(=S)(O)O)F

DOS

IR

Vibrations