Geometry & MOs

Info

ID:	18334
PubChem CID:	539662
Reduced:	OSN4C6H6 (1)
Stoich.:	ABC4D6E6 (1)
Weight, g/mol:	182.026232
ΔH_f, kcal/mol:	31.93
Dipole, Da:	2.27
IP(EA), eV:	-9.97(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-(cyanomethyl)-1,3,4-thiadiazol-2-yl]acetamide

Drug info:

PubChemData

Smile

CC(=O)NC1=NN=C(S1)CC#N

DOS

IR

Vibrations