Geometry & MOs

Info

ID:	311569
PubChem CID:	126593848
Reduced:	FN3O4H16C18 (1)
Stoich.:	AB3C4D16E18 (1)
Weight, g/mol:	235.106925
ΔH_f, kcal/mol:	-143.5
Dipole, Da:	9.61
IP(EA), eV:	-8.85(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-5-(4-aminoimidazo[2,1-f][1,2,4]triazin-7-yl)oxolan-2-yl]methanol

Drug info:

PubChemData

Smile

C1[C@H]([C@H](OC1N2C=NC3=C2C=CNC3=O)COC(=O)C4=CC=CC=C4)F

DOS

IR

Vibrations