Chem
J-GLOBAL ID：201207010377787235   Nikkaji number：J3.028.965J

1,2,1,2-[1,2-Diethyl-3,5-dimethyl-4,4-diphenyl-4H-3a-azonia-4-bora(IV)-4a-aza-s-indacene-6,7-diylbismethylidyne]-3,5-dimethyl-4,4-diphenyl-6,7-diethyl-1,2-dihydro-4H-3a-azonia-4-bora(IV)-4a-aza-s-indacene

1,2,1,2-[1,2-ジエチル-3,5-ジメチル-4,4-ジフェニル-4H-3a-アゾニア-4-ボラ(IV)-4a-アザ-s-インダセン-6,7-ジイルビスメチリジン]-3,5-ジメチル-4,4-ジフェニル-6,7-ジエチル-1,2-ジヒドロ-4H-3a-アゾニア-4-ボラ(IV)-4a-アザ-s-インダセン
Substance type：
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
Molecular formula： C56H56B2N2[N+]2
Molecular formula furigana： C56-H56-B2-N4
Molecular weight： 806.710
InChI： InChI=1S/C56H56B2N4/c1-9-45-37(5)59-53(47(45)11-3)35-55-51-33-50-40(8)62-56(52(50)34-49(51)39(7)61(55)57(59,41-25-17-13-18-26-41)42-27-19-14-20-28-42)36-54-48(12-4)46(10-2)38(6)60(54)58(62,43-29-21-15-22-30-43)44-31-23-16-24-32-44/h13-36H,9-12H2,1-8H3/q+2
InChI key： LEGWLTTZFLOJIJ-UHFFFAOYSA-N
SMILES： CCC1=C(CC)C2=Cc3n(c(C)c4cc5C6=Cc7c(CC)c(CC)c(C)n7[B](c7ccccc7)(c7ccccc7)[N+]6=C(C)c5cc34)[B](c3ccccc3)(c3ccccc3)[N+]2=C1C
Systematic name  (3)：
  • 1,2,1,2-[1,2-ジエチル-3,5-ジメチル-4,4-ジフェニル-4H-3a-アゾニア-4-ボラ(IV)-4a-アザ-s-インダセン-6,7-ジイルビスメチリジン]-3,5-ジメチル-4,4-ジフェニル-6,7-ジエチル-1,2-ジヒドロ-4H-3a-アゾニア-4-ボラ(IV)-4a-アザ-s-インダセン
  • 7,8,20,21-テトラエチル-9,13,22,26-テトラメチル-11,11,24,24-テトラフェニル-10λ5,12,23,25λ5-テトラアザ-11λ4,24λ4-ジボラヘプタシクロ[14.10.0.03,14.04,12.06,10.017,25.019,23]ヘキサコサ-1,3,5,7,9,13,15,17,19,21,25-ウンデカエン-10,25-ビス(イリウム)
  • 7,8,20,21-tetraethyl-9,13,22,26-tetramethyl-11,11,24,24-tetraphenyl-10λ5,12,23,25λ5-tetraaza-11λ4,24λ4-diboraheptacyclo[14.10.0.03,14.04,12.06,10.017,25.019,23]hexacosa-1,3,5,7,9,13,15,17,19,21,25-undecaene-10,25-bis(ylium)
Other name (1)：
  • 1,2,1,2-[1,2-Diethyl-3,5-dimethyl-4,4-diphenyl-4H-3a-azonia-4-bora(IV)-4a-aza-s-indacene-6,7-diylbismethylidyne]-3,5-dimethyl-4,4-diphenyl-6,7-diethyl-1,2-dihydro-4H-3a-azonia-4-bora(IV)-4a-aza-s-indacene
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM