14-Debromoprearaplysillin I

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Properties Simple | Detailed

Formula C21H24Br3N3O4
IUPAC Name (2e)-n-[3-[4-(2-aminoethyl)-2-bromo-phenoxy]propyl]-3-(3,5-dibromo-4-methoxy-phenyl)-2-hydroxyimino-propanamide
Molecular Mass 622.145 g·mol−1
Heat of Formation -357.3 ± 16.7 kJ·mol−1
Dipole Moment 5.06 ± 1.08 D
Volume 574.67 Å 3
Surface Area 394.75 Å 2
HOMO Energy -9.09 ± 0.55 eV
LUMO Energy -0.57 ± eV
Point Group Symmetry C1
Synonyms
  • (2e)-n-[3-[4-(2-aminoethyl)-2-bromo-phenoxy]propyl]-3-(3,5-dibromo-4-methoxy-phenyl)-2-hydroximino-propionamide
  • (2e)-n-[3-[4-(2-aminoethyl)-2-bromo-phenoxy]propyl]-3-(3,5-dibromo-4-methoxy-phenyl)-2-hydroxyimino-propanamide
  • (2e)-n-[3-[4-(2-aminoethyl)-2-bromophenoxy]propyl]-3-(3,5-dibromo-4-methoxyphenyl)-2-hydroxyiminopropanamide
CAS Number(s)
  • 136685-30-8
InChIKey DJJKDYYBOSZKDA-OVVQPSECSA-N
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DOI
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Elements H C O Br N