Geometry & MOs

Info

ID:	430664
PubChem CID:	135170730
Reduced:	SO2N4H16C17 (1)
Stoich.:	AB2C4D16E17 (1)
Weight, g/mol:	156.07212
ΔH_f, kcal/mol:	7.4
Dipole, Da:	8.78
IP(EA), eV:	-8.78(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-butyl-3-methyl-1,2,4-thiadiazole

Drug info:

PubChemData

Smile

CN1CC(C1)C(=O)NC2=CC=C(C=C2)C3=NC(=O)C4=C(N3)C=CS4

DOS

IR

Vibrations