Sb 224289

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Properties Simple | Detailed

Formula C26H26N4O3++
IUPAC Name [4-(2-methylenecyclopropyl)phenyl]-[(2z,4z)-1'-methylspiro[12-oxa-6-azabicyclo[7.3.0]dodeca-1(9),2,4-trien-7-yne-10,4'-pyridine]-6-yl]methanone; oxadiaziridine-2,3-diium
Molecular Mass 442.510 g·mol−1
Heat of Formation 4764.1 ± 16.7 kJ·mol−1
Dipole Moment 31.04 ± 1.08 D
Volume 490.44 Å 3
Surface Area 449.28 Å 2
HOMO Energy -6.97 ± 0.55 eV
LUMO Energy -4.70 ± eV
Point Group Symmetry C1
Synonyms
  • 1'-methyl-5-[[2'-methyl-4'-(5-methyl-1,2,4-oxadiazol-3-yl)biphenyl-4-yl]carbonyl]-2,3,6,7-tetrahydrospiro[furo[2,3-f]indole-3,4'-piperidine] hydrochloride
  • [4-[2-methyl-4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]phenyl]-(1'-methyl-5-spiro[6,7-dihydro-2h-furo[2,3-f]indole-3,4'-piperidine]yl)methanone
  • [4-[2-methyl-4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]phenyl]-(1'-methylspiro[6,7-dihydro-2h-furo[2,3-f]indole-3,4'-piperidine]-5-yl)methanone
  • sb224289
InChIKey ATQMRMGXINTJHV-UHFFFAOYSA-N
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