3-{[(2-{[(5R,6R,8R)-8-Hydroxy-7-(Hydroxymethyl)-5-(3,4,5-Trimethoxyphenyl)-5,6,7,8-Tetrahydronaphtho[2,3-D][1,3]Dioxol-6-Yl]Carbonyl}Hydrazino)Carbonyl]Amino}-2,2,5,5-Tetramethyl-2,5-Dihydro-1H-Pyrrol-1-Olate
Properties
Property | Value |
---|---|
Formula | C31H39N4O10- |
IUPAC Name | 1-[[(5r,6r,7r,8r)-8-hydroxy-7-(hydroxymethyl)-5-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxole-6-carbonyl]amino]-3-[(1s)-2,2,5,5-tetramethyl-1-oxido-pyrrol-3-yl]urea |
Molecular Mass | 627.662 g·mol−1 |
Heat of Formation | 2432.7 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.67 ± 1.08 D |
Volume | 678.93 Å 3 |
Surface Area | 528.3 Å 2 |
HOMO Energy | -9.26 ± 0.55 eV |
LUMO Energy | -2.40 ± eV |
Point Group Symmetry | C1 |
InChIKey | ZDNKVESNZAJGCN-QWBXGMEYSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | C O N |