Formula |
C21H23Cl2N3O3S |
IUPAC Name |
3-[(2,4-dichlorophenyl)methyl]-2-methyl-n-pentylsulfonyl-benzimidazol-3-ium-5-carboxamide |
Molecular Mass |
468.397 g·mol−1 |
Heat of Formation |
-418.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
6.15 ± 1.08 D |
Volume |
519.79 Å 3 |
Surface Area |
457.19 Å 2 |
HOMO Energy |
-9.49 ± 0.55 eV |
LUMO Energy |
-1.02 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 3-[(2,4-dichlorophenyl)methyl]-2-methyl-n-pentylsulfonyl-5-benzimidazolecarboxamide
- 3-[(2,4-dichlorophenyl)methyl]-2-methyl-n-pentylsulfonyl-benzimidazole-5-carboxamide
- 3-[(2,4-dichlorophenyl)methyl]-2-methyl-n-pentylsulfonylbenzimidazole-5-carboxamide
- n-amylsulfonyl-3-(2,4-dichlorobenzyl)-2-methyl-benzimidazole-5-carboxamide
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InChIKey |
UYGZODVVDUIDDQ-UHFFFAOYSA-N |
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Links |
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DOI |
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Downloads |
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Elements |
C
Cl
H
O
N
S
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