Formula |
C30H40N4O5 |
IUPAC Name |
[(1r,13s)-13-[(4-hydroxyphenyl)methyl]-12,20-dioxo-2,6,11,21-tetrazatricyclo[9.7.6.114,18]pentacosa-14,16,18(25)-trien-15-yl] acetate |
Molecular Mass |
536.662 g·mol−1 |
Heat of Formation |
-780.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
6.16 ± 1.08 D |
Volume |
647.0 Å 3 |
Surface Area |
462.91 Å 2 |
HOMO Energy |
-8.87 ± 0.55 eV |
LUMO Energy |
3.16 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- 1,6,10,22-tetraazatricyclo(9.7.6.112,16)pentacosa-12(25),13,15-triene-18,23-dione, 15-(acetyloxy)-17-((4-hydroxyphenyl)methyl)-, (11r-(11r*,17s*))-
- schweinine
|
CAS Number(s) |
|
InChIKey |
LSZMIIMBHCIRKT-RRPNLBNLSA-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
|
|
|