2,2,4,4,6,6-Hexa(1-Pyrrolidinyl)-1,3,5,2Lambda~5~,4Lambda~5~,6Lambda~5~-Triazatriphosphinine

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Properties Simple | Detailed

Formula C24H47N9P3
IUPAC Name (2s)-2-[(1s)-3,5-dihydro-2h-pyrrol-1-yl]-2,4,4-tripyrrolidin-1-yl-6,6-bis(2,3,4,5-tetrahydropyrrole-3,4-diid-1-yl)-1,3,5-triazanida-2,4,6-triphosphoniacyclohexane
Molecular Mass 554.612 g·mol−1
Heat of Formation 1512.5 ± 16.7 kJ·mol−1
Dipole Moment 3.63 ± 1.08 D
Volume 668.12 Å 3
Surface Area 457.52 Å 2
HOMO Energy -7.18 ± 0.55 eV
LUMO Energy -0.70 ± eV
Point Group Symmetry C1
Synonyms
  • 1,3,5,2,4,6-triazatriphosphorine, 2,2,4,4,6,6-hexahydro-2,2,4,4,6,6-hexa-1-pyrrolidinyl-
  • 2,2,4,4,6,6-hexa1-pyrrolidinyl-1,3,5-triaza-2$l^{5},4$l^{5},6$l^{5}-triphosphacyclohexa-1,3,5-triene
  • 2,2,4,4,6,6-hexapyrrolidin-1-yl-1,3,5-triaza-2$l^{5},4$l^{5},6$l^{5}-triphosphacyclohexa-1,3,5-triene
  • hexapyrrolidinocyclotriphosphazene
CAS Number(s)
  • 4864-72-6
InChIKey QXTBLBAUYVMZCO-UHFFFAOYSA-N
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