Formula |
C16H17N3S |
IUPAC Name |
3-amino-4-[2-[(dimethylamino)methyl]phenyl]sulfanyl-benzonitrile |
Molecular Mass |
283.391 g·mol−1 |
Heat of Formation |
317.9 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.29 ± 1.08 D |
Volume |
356.06 Å 3 |
Surface Area |
302.15 Å 2 |
HOMO Energy |
-8.46 ± 0.55 eV |
LUMO Energy |
-0.74 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 3-amino-4-[2-(dimethylaminomethyl)phenyl]sulfanyl-benzonitrile
- 3-amino-4-[2-(dimethylaminomethyl)phenyl]sulfanylbenzonitrile
- 3-amino-4-[[2-(dimethylaminomethyl)phenyl]thio]benzonitrile
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InChIKey |
UVWLEPXXYOYDGR-UHFFFAOYSA-N |
QR Code |
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Links |
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Downloads |
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Elements |
H
S
C
N
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