(2S,3R,4S,4Ar,11Br)-2,3,4,7-Tetrahydroxy-1,3,4,4A,5,11B-Hexahydro[1,3]Dioxolo[4,5-J]Phenanthridin-6(2H)-One
Properties
Property | Value |
---|---|
Formula | C14H15NO7 |
IUPAC Name | (2s,3s,4r,4ar,11bs)-2,3,4,7-tetrahydroxy-2,3,4,4a,5,11b-hexahydro-1h-[1,3]dioxolo[4,5-j]phenanthridin-6-one |
Molecular Mass | 309.271 g·mol−1 |
Heat of Formation | -1133.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.62 ± 1.08 D |
Volume | 318.71 Å 3 |
Surface Area | 274.95 Å 2 |
HOMO Energy | -9.06 ± 0.55 eV |
LUMO Energy | -0.92 ± eV |
Point Group Symmetry | C1 |
InChIKey | SBTGHBALOCEVOR-SKWMHJLTSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |