3,5-Diamino-N-[(Z)-Amino(1-Naphthyl)Methylene]-6-Chloro-2-Pyrazinecarboxamide

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Properties Simple | Detailed

Formula C16H13ClN6O
IUPAC Name (nz)-3,5-diamino-n-[amino(1-naphthyl)methylene]-6-chloro-pyrazine-2-carboxamide
Molecular Mass 340.767 g·mol−1
Heat of Formation 188.1 ± 16.7 kJ·mol−1
Dipole Moment 5.22 ± 1.08 D
Volume 373.22 Å 3
Surface Area 322.04 Å 2
HOMO Energy -8.97 ± 0.55 eV
LUMO Energy -0.80 ± eV
Point Group Symmetry C1
Synonyms
  • 3,5-diamino-6-chloro-n-(imino-1-naphthalenylmethyl)pyrazinecarboxamide
  • 3,5-diamino-n-(amino-naphthalen-1-yl-methylidene)-6-chloro-pyrazine-2-carboxamide
  • 3,5-diamino-n-(amino-naphthalen-1-ylmethylidene)-6-chloropyrazine-2-carboxamide
  • 3,5-diamino-n-[amino-(1-naphthyl)methylene]-6-chloro-2-pyrazinecarboxamide
  • 3,5-diamino-n-[amino-(1-naphthyl)methylene]-6-chloro-pyrazinamide
  • 3,5-diamino-n-[amino-(1-naphthyl)methylene]-6-chloro-pyrazine-2-carboxamide
  • alpha',2'-benzobenzamil
  • atbb
  • pyrazinecarboxamide, 3,5-diamino-6-chloro-n-(imino-1-naphthalenylmethyl)-
CAS Number(s)
  • 133906-28-2
InChIKey SHADDSMXSDFEBS-UHFFFAOYSA-N
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Elements H C N O Cl