Geometry & MOs

Info

ID:	208972
PubChem CID:	80608574
Reduced:	OSF3N3H10C11 (1)
Stoich.:	ABC3D3E10F11 (1)
Weight, g/mol:	263.109233
ΔH_f, kcal/mol:	-124.73
Dipole, Da:	1.71
IP(EA), eV:	-9.07(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(2,6-dimethylphenoxy)methyl]-N-ethyl-1,3,4-thiadiazol-2-amine

Drug info:

PubChemData

Smile

CNC1=NN=C(S1)COC2=CC=CC=C2C(F)(F)F

DOS

IR

Vibrations