Ergocristine
Properties
| Property | Value |
|---|---|
| Formula | C35H39N5O5 |
| IUPAC Name | (6ar,9r)-n-[(1s,2s,4r,7s)-7-benzyl-2-hydroxy-4-isopropyl-5,8-dioxo-3-oxa-6,9-diazatricyclo[7.3.0.02,6]dodecan-4-yl]-7-methyl-6,6a,8,9-tetrahydro-4h-indolo[4,3-fg]quinoline-9-carboxamide |
| Molecular Mass | 609.715 g·mol−1 |
| Heat of Formation | -573.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 7.61 ± 1.08 D |
| Volume | 721.38 Å 3 |
| Surface Area | 538.32 Å 2 |
| HOMO Energy | -8.44 ± 0.55 eV |
| LUMO Energy | -0.47 ± eV |
| Point Group Symmetry | C1 |
| CAS Number(s) |
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| InChIKey | HEFIYUQVAZFDEE-MKTPKCENSA-N |
| QR Code | Generate QR Code |
| Links | PubChem Wikipedia ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |