1-(2-{4-[(1Z)-1,2-Diphenyl-1-Buten-1-Yl]Phenoxy}Ethyl)Aziridine

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Properties Simple | Detailed

Formula C26H27NO
IUPAC Name 1-[2-[4-[(z)-1,2-diphenylbut-1-enyl]phenoxy]ethyl]aziridine
Molecular Mass 369.499 g·mol−1
Heat of Formation 252.7 ± 16.7 kJ·mol−1
Dipole Moment 1.89 ± 1.08 D
Volume 488.58 Å 3
Surface Area 406.58 Å 2
HOMO Energy -8.72 ± 0.55 eV
LUMO Energy 0.27 ± eV
Point Group Symmetry C1
Synonyms
  • 1-[2-[4-[(z)-1,2-di(phenyl)but-1-enyl]phenoxy]ethyl]aziridine
  • 1-[2-[4-[(z)-1,2-di(phenyl)but-1-enyl]phenoxy]ethyl]ethylenimine
  • aziridine, 1-(2-(4-(1,2-diphenyl-1-butenyl)phenoxy)ethyl)-, (z)-
  • tamoxifen aziridine
CAS Number(s)
  • 79642-44-7
InChIKey HODDDQIAUQRFRB-QPLCGJKRSA-N
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