| Formula |
C16H18N6O9S |
| IUPAC Name |
imino-[4-[(6-isocyanatooxy-6-oxo-hexa-1,4-diynyl)amino]-3-nitro-phenyl]imino-ammonium; 3-sulfonatoprop-1-yn-1-ol |
| Molecular Mass |
470.414 g·mol−1 |
| Heat of Formation |
1414.1 ± 16.7 kJ·mol−1 |
| Dipole Moment |
2.06 ± 1.08 D |
| Volume |
446.28 Å 3 |
| Surface Area |
429.79 Å 2 |
| HOMO Energy |
-9.06 ± 0.55 eV |
| LUMO Energy |
-1.15 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
UPNUQQDXHCUWSG-ZDUSSCGKSA-N |
| QR Code |
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| Links |
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| DOI |
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| Downloads |
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|
| Elements |
S
C
O
N
|
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