Geometry & MOs

Info

ID:	89910
PubChem CID:	49965335
Reduced:	S2N3O6H15C18 (1)
Stoich.:	A2B3C6D15E18 (1)
Weight, g/mol:	366.020495
ΔH_f, kcal/mol:	-166.84
Dipole, Da:	2.57
IP(EA), eV:	-9.06(-1.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-hydroxy-7-oxo-2-[2-oxo-2-(1H-1,2,4-triazol-5-ylamino)ethyl]sulfanyl-4H-thieno[3,2-b]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

C1OC2=C(O1)C=C(C=C2)CNC(=O)CSC3=C(C4=C(S3)C(=O)C=C(N4)O)C(=O)N

DOS

IR

Vibrations