| SpectraBase Compound ID | 4qU9TPFIisL |
|---|---|
| InChI | InChI=1S/2C12H5.C10H14N5O8P.2C2H6N2.2Ru/c2*1-3-7-11(8-4-1)12-9-5-2-6-10-12;11-10-13-7-4(8(18)14-10)12-2-15(7)9-6(17)5(16)3(23-9)1-22-24(19,20)21;2*3-1-2-4;;/h2*1,3-4,7-8H;2-3,5-6,9,16-17H,1H2,(H2,19,20,21)(H3,11,13,14,18);2*3-4H,1-2H2;;/q;;;2*-2;+2;+3/p-1/t;;3-,5-,6-,9-;;;;/m..1..../s1 |
| InChIKey | CWTKGOOCUOIXFZ-LMBVIKLKSA-M |
| Mol Weight | 978.9 g/mol |
| Molecular Formula | C38H35N9O8PRu2 |
| Exact Mass | 980.043301 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AodKsmb9RpH |
|---|---|
| Name | CWTKGOOCUOIXFZ-LMBVIKLKSA-M |
| Compound Number | RU-O-(PO3)-GMP-N7-RU |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C38H34N9O8PRu2 |
| InChI | InChI=1S/2C12H5.C10H14N5O8P.2C2H6N2.2Ru/c2*1-3-7-11(8-4-1)12-9-5-2-6-10-12;11-10-13-7-4(8(18)14-10)12-2-15(7)9-6(17)5(16)3(23-9)1-22-24(19,20)21;2*3-1-2-4;;/h2*1,3-4,7-8H;2-3,5-6,9,16-17H,1H2,(H2,19,20,21)(H3,11,13,14,18);2*3-4H,1-2H2;;/q;;;2*-2;+2;+3/p-1/t;;3-,5-,6-,9-;;;;/m..1..../s1 |
| InChIKey | CWTKGOOCUOIXFZ-LMBVIKLKSA-M |
| Literature Reference Author | H.CHEN,J.A.PARKINSON,R.E.MORRIS,P.J.SADLER |
| Literature Reference Citation | J.AM.CHEM.SOC.,125,173(2003) |
| Literature Reference DOI | 10.1021/ja027719m |
| Solvent | D2O:H2O=1:9 |
| Source File Reference | UWLU40323 |