| Formula |
C14H16N2O14S4 |
| IUPAC Name |
isocyanato 3-[(2-isocyanatooxy-2-oxo-ethyl)disulfanyl]prop-2-ynoate; 3-sulfonatoprop-1-yn-1-ol |
| Molecular Mass |
564.542 g·mol−1 |
| Heat of Formation |
-2125.1 ± 16.7 kJ·mol−1 |
| Dipole Moment |
8.31 ± 1.08 D |
| Volume |
550.62 Å 3 |
| Surface Area |
411.19 Å 2 |
| HOMO Energy |
-9.06 ± 0.55 eV |
| LUMO Energy |
-1.12 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
VOTJUWBJENROFB-HTQZYQBOSA-N |
| QR Code |
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| Links |
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| DOI |
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| Downloads |
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|
| Elements |
H
S
C
O
N
|
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