Geometry & MOs

Info

ID:	208958
PubChem CID:	80607832
Reduced:	OSN4C14H24 (1)
Stoich.:	ABC4D14E24 (1)
Weight, g/mol:	252.115716
ΔH_f, kcal/mol:	-35.55
Dipole, Da:	4.37
IP(EA), eV:	-8.53(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(3,5-diethyl-1,2,4-triazol-1-yl)methyl]-N-methyl-1,3,4-thiadiazol-2-amine

Drug info:

PubChemData

Smile

CCCNC1=NN=C(S1)CN2CCC(CCC2=O)(C)C

DOS

IR

Vibrations