| Formula |
C20H20Cl2N8O5 |
| IUPAC Name |
(2r)-2-[[3,5-dichloro-4-[(2,4-diaminopteridin-6-yl)methyl-methyl-amino]benzoyl]amino]pentanedioic acid |
| Molecular Mass |
523.329 g·mol−1 |
| Heat of Formation |
-648.4 ± 16.7 kJ·mol−1 |
| Dipole Moment |
3.29 ± 1.08 D |
| Volume |
548.96 Å 3 |
| Surface Area |
443.65 Å 2 |
| HOMO Energy |
-8.90 ± 0.55 eV |
| LUMO Energy |
-1.15 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
MCEHFIXEKNKSRW-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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