(1S,5S,7R)-N~7~-(4-Biphenylylmethyl)-N~3~-Hydroxy-6,8-Dioxa-3-Azabicyclo[3.2.1]Octane-3,7-Dicarboxamide

Molecule SVG Image

Properties Simple | Detailed

Formula C20H21N3O5
IUPAC Name (1s,5s,7r)-3-(hydroxycarbamoyl)-n-[(4-phenylphenyl)methyl]-6,8-dioxa-3-azabicyclo[3.2.1]octane-7-carboxamide
Molecular Mass 383.398 g·mol−1
Heat of Formation -486.7 ± 16.7 kJ·mol−1
Dipole Moment 3.53 ± 1.08 D
Volume 438.74 Å 3
Surface Area 379.99 Å 2
HOMO Energy -9.49 ± 0.55 eV
LUMO Energy -0.11 ± eV
Point Group Symmetry C1
Synonyms
  • (1s,5s,7r)-3-(hydroxycarbamoyl)-n-(4-phenylbenzyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane-7-carboxamide
  • (1s,5s,7r)-3-(hydroxycarbamoyl)-n-[(4-phenylphenyl)methyl]-6,8-dioxa-3-azabicyclo[3.2.1]octane-7-carboxamide
  • (1s,5s,7r)-3-[(hydroxyamino)-oxomethyl]-n-[(4-phenylphenyl)methyl]-6,8-dioxa-3-azabicyclo[3.2.1]octane-7-carboxamide
  • 37a
InChIKey PPLDARNGJSQINK-OKZBNKHCSA-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