Geometry & MOs

Info

ID:	24538
PubChem CID:	610777
Reduced:	SN6C7H10 (1)
Stoich.:	AB6C7D10 (1)
Weight, g/mol:	210.068766
ΔH_f, kcal/mol:	109.02
Dipole, Da:	3.65
IP(EA), eV:	-8.83(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-5-(3,5-dimethylpyrazol-1-yl)-1,2,4-triazole-3-thiol

Drug info:

PubChemData

Smile

CC1=CC(=NN1C2=NN=C(N2N)S)C

DOS

IR

Vibrations