Geometry & MOs

Info

ID:	120677
PubChem CID:	50739980
Reduced:	O2S2N4C11H12 (1)
Stoich.:	A2B2C4D11E12 (1)
Weight, g/mol:	266.047361
ΔH_f, kcal/mol:	40.24
Dipole, Da:	4.23
IP(EA), eV:	-8.98(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]-1-oxidopyridin-1-ium-4-carboxamide

Drug info:

PubChemData

Smile

CCCSC1=NN=C(S1)NC(=O)C2=CC=[N+](C=C2)[O-]

DOS

IR

Vibrations