6-Butyl-4,10-Dioxo-3,5,7,9-Tetrahydro-1H-1,7-Phenanthroline-2,3,4A,5,6,6A,8,9,10A,10B-Decaide-2,8-Dicarboxylic Acid
Properties
Property | Value |
---|---|
Formula | C18H28N2O6++ |
IUPAC Name | (2s,4ar,6s,6as,8s,10as,10br)-6-butyl-4,10-dioxo-1,2,3,4a,5,6,6a,7,8,9,10a,10b-dodecahydro-1,7-phenanthroline-1,7-diium-2,8-dicarboxylic acid |
Molecular Mass | 368.425 g·mol−1 |
Heat of Formation | -917.0 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.64 ± 1.08 D |
Volume | 391.37 Å 3 |
Surface Area | 347.8 Å 2 |
HOMO Energy | -8.97 ± 0.55 eV |
LUMO Energy | 1.41 ± eV |
Point Group Symmetry | C1 |
InChIKey | KJCJRDYNRLDPAS-UHFFFAOYSA-P |
QR Code | Generate QR Code |
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Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |