Geometry & MOs

Info

ID:	124788
PubChem CID:	50895990
Reduced:	OSN5C19H21 (1)
Stoich.:	ABC5D19E21 (1)
Weight, g/mol:	294.009058
ΔH_f, kcal/mol:	48.73
Dipole, Da:	4.55
IP(EA), eV:	-8.48(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(3-chlorophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole-3-carbohydrazide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC4=C(C=C3)N=C(S4)NN

DOS

IR

Vibrations