N-(5-Chrysenylmethyl)-7H-Purin-6-Amine

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Properties Simple | Detailed

Formula C24H17N5
IUPAC Name n-(chrysen-5-ylmethyl)-7h-purin-6-amine
Molecular Mass 375.425 g·mol−1
Heat of Formation 637.4 ± 16.7 kJ·mol−1
Dipole Moment 8.33 ± 1.08 D
Volume 432.34 Å 3
Surface Area 376.23 Å 2
HOMO Energy -8.75 ± 0.55 eV
LUMO Energy -1.17 ± eV
Point Group Symmetry C1
Synonyms
  • 1h-purin-6-amine, n-(5-chrysenylmethyl)-
  • n(6)-((chrysen-5-yl)methyl)adenine
  • n-(chrysen-5-ylmethyl)-7h-purin-6-amine
CAS Number(s)
  • 117606-16-3
InChIKey CTFRLNJWYCKBNP-UHFFFAOYSA-N
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Elements H C N