5-(Ethylcarbamothioylamino)-2-(3-Hydroxy-6-Oxo-Xanthen-9-Yl)Benzoic Acid
Properties
Property | Value |
---|---|
Formula | C23H18N2O5S |
IUPAC Name | 5-(ethylcarbamothioylamino)-2-(3-hydroxy-6-oxo-2,4-dihydro-1h-xanthene-1,2,3,4,4a,8a,9,9a-octaid-9-yl)benzoic acid |
Molecular Mass | 434.464 g·mol−1 |
Heat of Formation | -436.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.62 ± 1.08 D |
Volume | 492.58 Å 3 |
Surface Area | 406.53 Å 2 |
HOMO Energy | -8.74 ± 0.55 eV |
LUMO Energy | 1.25 ± eV |
Point Group Symmetry | C1 |
InChIKey | VHJFQSRUDVDTEO-UHFFFAOYSA-N |
QR Code | Generate QR Code |
Links | PubChem |
DOI | |
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Elements | H S C O N |