Formula |
C15H15N4O2S+ |
IUPAC Name |
n-[[4-(aminomethyl)phenyl]methyl]-4-oxo-3h-thieno[2,3-d]pyrimidin-1-ium-4a-ide-5-carboxamide |
Molecular Mass |
315.370 g·mol−1 |
Heat of Formation |
-69.9 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.30 ± 1.08 D |
Volume |
353.57 Å 3 |
Surface Area |
316.85 Å 2 |
HOMO Energy |
-9.14 ± 0.55 eV |
LUMO Energy |
1.48 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
ZOJIHHOGTNVURO-UHFFFAOYSA-O |
QR Code |
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Links |
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Downloads |
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Elements |
H
C
S
O
N
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