Chem
J-GLOBAL ID:201507013717332140
Nikkaji number:J3.428.969G
18d,18f,18h-Triaza-18e,18g,18i-tribora-18d,18e,18f,18g,18h,18i-hexahydrohexabenzo[bc,ef,hi,kl,no,qr]coronene
18d,18f,18h-トリアザ-18e,18g,18i-トリボラ-18d,18e,18f,18g,18h,18i-ヘキサヒドロヘキサベンゾ[bc,ef,hi,kl,no,qr]コロネン
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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:
C36 H18 B3 N3
Molecular formula furigana:
C36-H18-B3-N3
Molecular weight:
524.990
InChI:
InChI=1S/C36H18B3N3/c1-7-19-25-13-4-15-27-21-9-2-11-23-29-17-6-18-30-24-12-3-10-22-28-16-5-14-26-20(8-1)31(19)37-40(34(25)27)38(32(21)23)42(36(29)30)39(33(22)24)41(37)35(26)28/h1-18H
InChI key:
KQURGAUDKCDINZ-UHFFFAOYSA-N
SMILES:
c1cc2c3cccc4c5cccc6c7cccc8c9cccc%10c%11cccc%12c(c1)c2B1N(B(N(B(N1c%11%12)c9%10)c78)c56)c34
Systematic name (3):
18d,18f,18h-トリアザ-18e,18g,18i-トリボラ-18d,18e,18f,18g,18h,18i-ヘキサヒドロヘキサベンゾ[bc,ef,hi,kl,no,qr]コロネン
1,15,29-トリアザ-2,16,30-トリボラトリデカシクロ[28.12.0.02,15 .03,8 .04,41 .09,14 .013,18 .016,29 .017,22 .023,28 .027,32 .031,36 .037,42 ]ドテトラコンタ-3,5,7,9(14),10,12,17,19,21,23(28),24,26,31,33,35,37(42),38,40-オクタデカエン
1,15,29-triaza-2,16,30-triboratridecacyclo[28.12.0.02,15 .03,8 .04,41 .09,14 .013,18 .016,29 .017,22 .023,28 .027,32 .031,36 .037,42 ]dotetraconta-3,5,7,9(14),10,12,17,19,21,23(28),24,26,31,33,35,37(42),38,40-octadecaene
Other name (1):
18d,18f,18h-Triaza-18e,18g,18i-tribora-18d,18e,18f,18g,18h,18i-hexahydrohexabenzo[bc,ef,hi,kl,no,qr]coronene
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