Geometry & MOs

Info

ID:	209046
PubChem CID:	80617012
Reduced:	OS2N5C11H15 (1)
Stoich.:	AB2C5D11E15 (1)
Weight, g/mol:	267.090229
ΔH_f, kcal/mol:	25.11
Dipole, Da:	3.66
IP(EA), eV:	-9.01(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(methylamino)-N-[3-(1H-1,2,4-triazol-5-yl)propyl]-1,3,4-thiadiazole-2-carboxamide

Drug info:

PubChemData

Smile

CCNC1=NN=C(S1)C(=O)NC(C)C2=NC(=CS2)C

DOS

IR

Vibrations