(3R,5S)-3-(Hydroxymethyl)-1-Azabicyclo[3.2.0]Heptan-7-One

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Properties Simple | Detailed

Formula C7H11NO2
IUPAC Name (3r,5s)-3-(hydroxymethyl)-1-azabicyclo[3.2.0]heptan-7-one
Molecular Mass 141.168 g·mol−1
Heat of Formation -280.2 ± 16.7 kJ·mol−1
Dipole Moment 4.89 ± 1.08 D
Volume 173.63 Å 3
Surface Area 172.23 Å 2
HOMO Energy -9.65 ± 0.55 eV
LUMO Energy 3.81 ± eV
Point Group Symmetry C1
Synonyms
  • (3r,5s)-3-methylol-1-azabicyclo[3.2.0]heptan-7-one
  • 2-hydroxymethyl-1-carbapenam
CAS Number(s)
  • 139748-18-8
InChIKey KEPDSXDHKHNILW-RITPCOANSA-N
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