| SpectraBase Spectrum ID |
9lcFklbSECu |
| Name |
(2-Methyl-3-deuterio-5,10,15,20-tetraphenylporphyrinato)nickel |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C45H29DN4Ni |
| InChI |
InChI=1S/C45H30N4.Ni/c1-29-28-40-43(32-18-10-4-11-19-32)38-25-24-36(47-38)41(30-14-6-2-7-15-30)34-22-23-35(46-34)42(31-16-8-3-9-17-31)37-26-27-39(48-37)44(45(29)49-40)33-20-12-5-13-21-33;/h2-28H,1H3;/q-2;+2/b41-34-,41-36-,42-35-,42-37-,43-38-,43-40-,44-39-,45-44-;/i28D; |
| InChIKey |
ZWSVNOVACOCLJR-NKDRZTNRSA-N |
| Molecular Weight |
686.463 g/mol |
| SMILES |
c12[n]3c(c(c2[D])C)c(c2nc(c(c4[n]([Ni]3)c(c(-c3ccccc3)c3nc(c1-c1ccccc1)cc3)cc4)-c1ccccc1)cc2)-c1ccccc1 |
| SPLASH |
splash10-000i-0000009000-b3369c2397a72f1c19ac |
| Source of Spectrum |
J-59-4436-20 |
| Wiley ID |
1414493 |
