2-[6-(Dimethylamino)-3-(Dimethyliminio)-3H-Xanthen-9-Yl]-5-Formylbenzoate
Properties
Property | Value |
---|---|
Formula | C25H22N2O4 |
IUPAC Name | 2-[3-(dimethylamino)-6-dimethyliminio-2,4-dihydro-1h-xanthene-1,2,3,4,4a,8a,9,9a-octaid-9-yl]-5-formyl-benzoate |
Molecular Mass | 414.453 g·mol−1 |
Heat of Formation | 3514.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 15.36 ± 1.08 D |
Volume | 497.88 Å 3 |
Surface Area | 394.17 Å 2 |
HOMO Energy | -8.25 ± 0.55 eV |
LUMO Energy | -4.39 ± eV |
Point Group Symmetry | C1 |
InChIKey | ZFGLYCCNMJCDCP-UHFFFAOYSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
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Elements | C O N |