4-Isothiocyanatobenzoic Acid
Properties
| Property | Value |
|---|---|
| Formula | C8H5NO2S |
| IUPAC Name | 4-isothiocyanatobenzoic acid |
| Molecular Mass | 179.196 g·mol−1 |
| Heat of Formation | -116.2 ± 16.7 kJ·mol−1 |
| Dipole Moment | 1.54 ± 1.08 D |
| Volume | 196.82 Å 3 |
| Surface Area | 200.25 Å 2 |
| HOMO Energy | -9.12 ± 0.55 eV |
| LUMO Energy | 1.35 ± eV |
| Point Group Symmetry | Cs |
| Synonyms |
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| CAS Number(s) |
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| InChIKey | RBEFRYQKJYMLCC-UHFFFAOYSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H S C O N |