| Formula |
C20H21ClN8O5 |
| IUPAC Name |
(2r)-2-[[3-chloro-4-[(2,4-diaminopteridin-6-yl)methyl-methyl-amino]benzoyl]amino]pentanedioic acid |
| Molecular Mass |
488.884 g·mol−1 |
| Heat of Formation |
-675.3 ± 16.7 kJ·mol−1 |
| Dipole Moment |
2.43 ± 1.08 D |
| Volume |
527.17 Å 3 |
| Surface Area |
389.83 Å 2 |
| HOMO Energy |
-8.97 ± 0.55 eV |
| LUMO Energy |
-1.10 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
IYLMHKCROXNDKO-GFCCVEGCSA-N |
| QR Code |
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| Links |
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| DOI |
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| Downloads |
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|
| Elements |
H
C
N
O
Cl
|
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