Formula |
C24H17N5O |
IUPAC Name |
2-(chrysen-5-ylmethylamino)-7,8-dihydro-3h-purine-1,2,4,5,8,9-hexaid-6-one |
Molecular Mass |
391.425 g·mol−1 |
Heat of Formation |
426.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.65 ± 1.08 D |
Volume |
442.24 Å 3 |
Surface Area |
388.2 Å 2 |
HOMO Energy |
-8.72 ± 0.55 eV |
LUMO Energy |
-1.34 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 2-(5-chrysenylmethylamino)-3,7-dihydropurin-6-one
- 2-(chrysen-5-ylmethylamino)-3,7-dihydropurin-6-one
- 6h-purin-6-one, 2-((5-chrysenylmethyl)amino)-1,7-dihydro-
- n(2)-((chrysen-5-yl)methyl)guanine
- n2-cymg
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CAS Number(s) |
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InChIKey |
XINSXRDSIDZSGC-UHFFFAOYSA-N |
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Links |
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DOI |
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Elements |
H
C
O
N
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