Ceratinamine

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Properties Simple | Detailed

Formula C13H15Br2N3O2
IUPAC Name n-[3-[4-(2-aminoethyl)-2,6-dibromo-phenoxy]propyl]-1-cyano-formamide
Molecular Mass 405.085 g·mol−1
Heat of Formation -102.0 ± 16.7 kJ·mol−1
Dipole Moment 4.31 ± 1.08 D
Volume 368.54 Å 3
Surface Area 301.12 Å 2
HOMO Energy -9.47 ± 0.55 eV
LUMO Energy 2.11 ± eV
Point Group Symmetry C1
Synonyms
  • n-[3-[4-(2-aminoethyl)-2,6-dibromo-phenoxy]propyl]-1-cyano-formamide
  • n-[3-[4-(2-aminoethyl)-2,6-dibromo-phenoxy]propyl]-1-cyano-methanamide
  • n-[3-[4-(2-aminoethyl)-2,6-dibromophenoxy]propyl]-1-cyanoformamide
InChIKey VLXGYEMZRIGDRH-UHFFFAOYSA-N
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Elements H C O Br N