6-{[(2,5-Dichlorophenyl)Amino]Methyl}Pyrido[2,3-D]Pyrimidine-2,4-Diamine

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Properties Simple | Detailed

Formula C14H12Cl2N6
IUPAC Name 6-[(2,5-dichloroanilino)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine
Molecular Mass 335.191 g·mol−1
Heat of Formation 286.7 ± 16.7 kJ·mol−1
Dipole Moment 4.71 ± 1.08 D
Volume 356.4 Å 3
Surface Area 330.94 Å 2
HOMO Energy -8.76 ± 0.55 eV
LUMO Energy 1.96 ± eV
Point Group Symmetry C1
Synonyms
  • (2,4-diaminopyrido[6,5-d]pyrimidin-6-yl)methyl-(2,5-dichlorophenyl)amine
  • 2,4-diamino-6-[(2',5'-dichoroanilino)methyl]pyrido[2,3-d]pyrimidine
InChIKey RSPDQFOJWPXTPN-UHFFFAOYSA-N
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Elements H C Cl N