Formula |
C24H20Cl2N2OS |
IUPAC Name |
3-[(2r)-2-(2,4-dichlorophenyl)-2-[(4-phenylsulfanylphenyl)methoxy]ethyl]-4h-imidazol-3-ium-4-ylium |
Molecular Mass |
455.399 g·mol−1 |
Heat of Formation |
163.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.72 ± 1.08 D |
Volume |
526.59 Å 3 |
Surface Area |
398.26 Å 2 |
HOMO Energy |
-8.28 ± 0.55 eV |
LUMO Energy |
-0.90 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
ZCJYUTQZBAIHBS-DEOSSOPVSA-N |
QR Code |
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Links |
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Elements |
C
Cl
H
O
N
S
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