2-[11-{1-Hydroxy-2-[(3-Methylbutyl)Amino]Ethyl}-6,9-Dioxo-2-Oxa-7,10-Diazabicyclo[11.2.2]Heptadeca-1(15),13,16-Trien-8-Yl]Acetamide

Molecule SVG Image

Properties Simple | Detailed

Formula C23H36N4O5
IUPAC Name 2-[(3s,6s)-3-[(1r)-1-hydroxy-2-(isopentylamino)ethyl]-5,8-dioxo-12-oxa-4,7-diazabicyclo[11.2.2]heptadeca-1(16),13(17),14-trien-6-yl]acetamide
Molecular Mass 448.556 g·mol−1
Heat of Formation -1001.5 ± 16.7 kJ·mol−1
Dipole Moment 6.50 ± 1.08 D
Volume 559.1 Å 3
Surface Area 456.25 Å 2
HOMO Energy -8.88 ± 0.55 eV
LUMO Energy 3.33 ± eV
Point Group Symmetry C1
InChIKey SCRDVDSVEKGWGQ-SLFFLAALSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N