[(8S,9S,10R,11R,12R,13R,14S,15R,20S,21R)-8-Hydroxy-20,21-Dimethyl-16,17,18,19-Tetraoxo-34,35,36,37-Tetraoxa-22,23,24,25-Tetrazahexacyclo[Blah.Blah.Blah.Blah.Blah.Blah.Blah]Hexacosan-13-Yl]Methyl Dihydrogen Phosphate
Properties
Property | Value |
---|---|
Formula | C21H29N4O13P |
IUPAC Name | [(8s,9s,10r,11r,12r,13r,14s,15r,20s,21r)-8-hydroxy-20,21-dimethyl-16,17,18,19-tetraoxo-34,35,36,37-tetraoxa-22,23,24,25-tetrazahexacyclo[blah.blah.blah.blah.blah.blah.blah]hexacosan-13-yl]methyl dihydrogen phosphate |
Molecular Mass | 576.448 g·mol−1 |
Heat of Formation | -2538.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 13.76 ± 1.08 D |
Volume | 588.5 Å 3 |
Surface Area | 426.52 Å 2 |
HOMO Energy | -9.48 ± 0.55 eV |
LUMO Energy | 0.02 ± eV |
Point Group Symmetry | C1 |
InChIKey | OEDVFXVLZFMULF-LLNRWBJTSA-N |
QR Code | Generate QR Code |
Links | |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | P C H O N |