Geometry & MOs

Info

ID:	210169
PubChem CID:	80769196
Reduced:	SF2O2N4H10C12 (1)
Stoich.:	AB2C2D4E10F12 (1)
Weight, g/mol:	297.067345
ΔH_f, kcal/mol:	-116.02
Dipole, Da:	4.28
IP(EA), eV:	-8.88(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-(2,2-difluoro-1,3-benzodioxol-5-yl)-6-methoxy-1,3,5-triazine-2,4-diamine

Drug info:

PubChemData

Smile

CSC1=NC(=CC(=N1)NC2=CC3=C(C=C2)OC(O3)(F)F)N

DOS

IR

Vibrations