Chem
J-GLOBAL ID：200907036130400234
Nikkaji number：J1.564.610A
3,4-Dicyano-1,3,5-cycloheptatriene-7-ylium
3,4-ジシアノ-1,3,5-シクロヘプタトリエン-7-イリウム
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Molecular formula： C8[C+]H5N2
Molecular formula furigana： C9-H5-N2
Molecular weight： 141.152
InChI：
InChI=1S/C9H5N2/c10-6-8-4-2-1-3-5-9(8)7-11/h1-5H/q+1
InChI key：
KIGWFGYZDCNREQ-UHFFFAOYSA-N
SMILES：
N#CC1=C(C=C[CH+]C=C1)C#N
Systematic name (3)：
- 3,4-ジシアノ-1,3,5-シクロヘプタトリエン-7-イリウム
- 4,5-ジシアノシクロヘプタ-2,4,6-トリエン-1-イリウム
- 4,5-dicyanocyclohepta-2,4,6-trien-1-ylium
- 3,4-Dicyano-1,3,5-cycloheptatriene-7-ylium
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