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January 28, 2026
C5N4
Datos Químicos de C5N4
ID
33390
Molecular Formula
C5N4
Elemental Composition %
C: 55.5555555555556%
H: 0%
O: 0%
N: 44.4444444444444%
Weight
116.083
Programa de Cálculo
G16
SMILES
N#CC(C#N)(C#N)C#N
Nivel de Teoría
B3LYP/6-31G(2df, p)
InChI
InChI=1S/C5N4/c6-1-5(2-7,3-8)4-9
Calculation Keys
# B3LYP/6-31G(2df,p) scf=(maxcycle=9999) nosymm output=wfx
InChIKey
XKGUKYPCHPHAJL-UHFFFAOYSA-N