| Formula |
C15H13F2N3O3S |
| IUPAC Name |
n-(2-cyanoethyl)-2,2-bis(fluoromethyl)-6-nitro-chromene-4-carbothioamide |
| Molecular Mass |
353.344 g·mol−1 |
| Heat of Formation |
-239.0 ± 16.7 kJ·mol−1 |
| Dipole Moment |
8.79 ± 1.08 D |
| Volume |
388.71 Å 3 |
| Surface Area |
326.75 Å 2 |
| HOMO Energy |
-8.81 ± 0.55 eV |
| LUMO Energy |
-1.47 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- n-(2-cyanoethyl)-2,2-bis(fluoromethyl)-6-nitro-4-chromenecarbothioamide
- n-(2-cyanoethyl)-2,2-bis(fluoromethyl)-6-nitro-chromene-4-carbothioamide
- n-(2-cyanoethyl)-2,2-bis(fluoromethyl)-6-nitrochromene-4-carbothioamide
|
| InChIKey |
LKUDLWNQCZSCQW-UHFFFAOYSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
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|
| DOI |
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| Downloads |
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|
| Elements |
C
F
H
O
N
S
|
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