Formula |
C12H23N3O3S2 |
IUPAC Name |
(z)-n-[(2-{5-[(dimethylamino)methyl]tetrahydro-2-furanyl}ethyl)sulfanyl]-1-(methylsulfanyl)-2-nitroethenamine |
Molecular Mass |
321.459 g·mol−1 |
Heat of Formation |
2293.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
8.48 ± 1.08 D |
Volume |
345.03 Å 3 |
Surface Area |
316.33 Å 2 |
HOMO Energy |
-9.63 ± 0.55 eV |
LUMO Energy |
-2.85 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
STDMFOCOBBMIAD-PPECIPICSA-N |
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Elements |
H
S
C
O
N
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