Formula |
C20H19F2N5O2++ |
IUPAC Name |
[amino-[3-[[6-[3-[amino(azaniumylidene)methyl]phenoxy]-3,5-difluoro-4-methyl-2-pyridyl]oxy]phenyl]methylene]ammonium |
Molecular Mass |
399.394 g·mol−1 |
Heat of Formation |
-257.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
0.55 ± 1.08 D |
Volume |
432.0 Å 3 |
Surface Area |
342.4 Å 2 |
HOMO Energy |
-9.27 ± 0.55 eV |
LUMO Energy |
-0.63 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- [amino-[3-[6-[3-(amino-azaniumylidene-methyl)phenoxy]-3,5-difluoro-4-methyl-pyridin-2-yl]oxyphenyl]methylidene]azanium
- [amino-[3-[[6-[3-(amino-azaniumylidene-methyl)phenoxy]-3,5-difluoro-4-methyl-2-pyridyl]oxy]phenyl]methylene]ammonium
- [amino-[3-[[6-[3-(amino-iminio-methyl)phenoxy]-3,5-difluoro-4-methyl-2-pyridyl]oxy]phenyl]methylene]ammonium
- [amino-[3-[[6-[3-(amino-iminiomethyl)phenoxy]-3,5-difluoro-4-methyl-2-pyridyl]oxy]phenyl]methylene]ammonium
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InChIKey |
ZXIHYCYAQUQHSG-UHFFFAOYSA-P |
QR Code |
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Links |
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Downloads |
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Elements |
H
C
N
O
F
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