Formula |
C19H18N6O4 |
IUPAC Name |
1,3-diamino-8-(3,4,5-trimethoxyphenyl)pyrimido[4,5-c][2,7]naphthyridin-8-ium-5-id-6-one |
Molecular Mass |
394.384 g·mol−1 |
Heat of Formation |
-107.9 ± 16.7 kJ·mol−1 |
Dipole Moment |
16.40 ± 1.08 D |
Volume |
430.65 Å 3 |
Surface Area |
383.15 Å 2 |
HOMO Energy |
-8.52 ± 0.55 eV |
LUMO Energy |
1.47 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- 1,3-diamino-8-(3',4',5'-trimethoxyphenyl)pyrimido[4,5-c][2,7]naphthyridin-6-one
|
InChIKey |
PBZONEKKFAKAJA-UHFFFAOYSA-N |
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Links |
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Elements |
H
C
O
N
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