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5,5,11,11-TETRAPHENYL-5,6,11,12-TETRAHYDRO-6,12-BIIMINODIBENZO-[B,F]-[1,5]-DIPHOSPHOCINIUM-DIPERCHLORATE
SpectraBase Compound ID LOIfH6jTex3
InChI InChI=1S/C38H32N2P2.2ClHO4.H2O/c1-5-17-29(18-6-1)41(30-19-7-2-8-20-30)35-27-15-13-25-33(35)38-40-39-37(41)34-26-14-16-28-36(34)42(38,31-21-9-3-10-22-31)32-23-11-4-12-24-32;2*2-1(3,4)5;/h1-28,37-40H;2*(H,2,3,4,5);1H2/q+2;;;/p-2
InChIKey ZJDCWOBQDZGWNL-UHFFFAOYSA-L
Mol Weight 795.55 g/mol
Molecular Formula C38H34Cl2N2O9P2
Exact Mass 794.11166 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C0EszeEhrGR
Name 5,5,11,11-TETRAPHENYL-5,6,11,12-TETRAHYDRO-6,12-BIIMINODIBENZO-[B,F]-[1,5]-DIPHOSPHOCINIUM-DIPERCHLORATE
Compound Number 1.H2O
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H34Cl2N2O9P2
InChI InChI=1S/C38H32N2P2.2ClHO4.H2O/c1-5-17-29(18-6-1)41(30-19-7-2-8-20-30)35-27-15-13-25-33(35)38-40-39-37(41)34-26-14-16-28-36(34)42(38,31-21-9-3-10-22-31)32-23-11-4-12-24-32;2*2-1(3,4)5;/h1-28,37-40H;2*(H,2,3,4,5);1H2/q+2;;;/p-2
InChIKey ZJDCWOBQDZGWNL-UHFFFAOYSA-L
Literature Reference Author M.MIELENKOVIC,B.WARZAJTIS,U.RYCHLEWSKA,D.RADANOVIC,K.ANDELKO VIC,T.BOZIC,M.VUJCIC
Literature Reference Citation MOLECULES,17,2567(2012)
Literature Reference DOI 10.3390/molecules17032567
Solvent CD3CN
Source File Reference UWBT1834