SpectraBase Spectrum ID |
LnKMrHeNarc |
Name |
2,8,14,20-Tetrathia-25,27-diazapentacyclo[19.3.1.1(3,7).1(9,13).1(15,19)]oc tacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecaene, 4,6,16,18-tetranitro- |
CAS Registry Number |
78649-05-5 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C22H10N6O8S4 |
InChI |
InChI=1S/C22H10N6O8S4/c29-25(30)11-7-13(27(33)34)17-9-15(11)37-19-3-1-4-20(23-19)38-16-10-18(14(28(35)36)8-12(16)26(31)32)40-22-6-2-5-21(24-22)39-17/h1-10H |
InChIKey |
WFVKBFAPDFGICH-UHFFFAOYSA-N |
Molecular Weight |
614.596 g/mol |
SMILES |
c1(N(=O)=O)c2Sc3nc(Sc4c(N(=O)=O)cc(c(Sc5nc(Sc(c(c1)N(=O)=O)c2)ccc5)c4)N(=O)=O)ccc3 |
SPLASH |
splash10-014i-0000090000-80e50d70f47a4a6ade9d |
Source of Spectrum |
0-16-190-1 |
Synonyms |
10,12,24,26-Tetranitro-1,8,15,22-tetrathia-bis((1)(2,6-spyridino(1)-metacyclophane))
4,6,16,18-tetranitro-2,8,14,20-tetrathia-25,27-diazapentacyclo[19.3.1.1(3,7).1(9,13).1(15,19)]octacosa-1(25),3(28),4,6,9(27),10,12,15(26),16,18,21,23-dodecaene |
Wiley ID |
1411155 |