Geometry & MOs

Info

ID:	69805
PubChem CID:	47205424
Reduced:	OSN4H10C13 (1)
Stoich.:	ABC4D10E13 (1)
Weight, g/mol:	261.043279
ΔH_f, kcal/mol:	71.17
Dipole, Da:	8.74
IP(EA), eV:	-9.39(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3,4-thiadiazol-2-yl)-2-([1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CNC=C2C(=O)NC3=NN=CS3

DOS

IR

Vibrations