2,3-Dihydro-6,7-Diphenyl-1H-Pyrrolizine-5-Acetaldehyde

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Properties Simple | Detailed

Formula C21H19NO
IUPAC Name 2-(1,2-diphenyl-6,7-dihydro-5h-pyrrolizin-4-ium-8-ylium-3-yl)acetaldehyde
Molecular Mass 301.382 g·mol−1
Heat of Formation 138.8 ± 16.7 kJ·mol−1
Dipole Moment 2.02 ± 1.08 D
Volume 375.56 Å 3
Surface Area 322.14 Å 2
HOMO Energy -8.50 ± 0.55 eV
LUMO Energy 0.13 ± eV
Point Group Symmetry C1
Synonyms
  • 1h-pyrrolizine-5-acetaldehyde, 2,3-dihydro-6,7-diphenyl-
  • 2-[1,2-di(phenyl)-6,7-dihydro-5h-pyrrolizin-3-yl]ethanal
  • 6,7-diphenyl-2,3-dihydro-1h-pyrrolizin-5-yl-acetaldehyde
  • dadhp-5-acetaldehyde
CAS Number(s)
  • 105378-65-2
InChIKey CMOCEULWRYSFTQ-UHFFFAOYSA-N
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