(4S,10S,16S,19S)-4-[(2R)-2-Butanyl]-19-Isobutyl-16-{[(2-Methyl-3-Buten-2-Yl)Oxy]Methyl}-21-Thia-3,6,12,15,18,23-Hexaazatricyclo[18.2.1.0~6,10~]Tricosa-1(22),20(23)-Diene-2,5,11,14,17-Pentone
Properties
Property | Value |
---|---|
Formula | C30H46N6O6S |
IUPAC Name | (4s,10s,16s,19s)-4-[(2r)-2-butanyl]-19-isobutyl-16-{[(2-methyl-3-buten-2-yl)oxy]methyl}-21-thia-3,6,12,15,18,23-hexaazatricyclo[18.2.1.0 6,10 ]tricosa-1(22),20(23)-diene-2,5,11,14,17-pentone |
Molecular Mass | 618.788 g·mol−1 |
Heat of Formation | -1058.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.22 ± 1.08 D |
Volume | 774.02 Å 3 |
Surface Area | 558.34 Å 2 |
HOMO Energy | -9.26 ± 0.55 eV |
LUMO Energy | -1.01 ± eV |
Point Group Symmetry | C1 |
InChIKey | XUWMKNIBSBACMR-ZFJRXVOLSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H S C O N |