Geometry & MOs

Info

ID:	183584
PubChem CID:	77043275
Reduced:	N4O5C10H12 (1)
Stoich.:	A4B5C10D12 (1)
Weight, g/mol:	288.064074
ΔH_f, kcal/mol:	-174.42
Dipole, Da:	2.74
IP(EA), eV:	-9.95(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-dioxo-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]-1,3-diazinane-5-sulfonamide

Drug info:

PubChemData

Smile

C1C(CC(=O)NC1O)C(=O)NC2=NNC(=C2)C(=O)O

DOS

IR

Vibrations