Formula |
C10H12N2O2 |
IUPAC Name |
(5s)-1-methyl-5-(1-oxidopyridin-1-ium-3-yl)pyrrolidin-2-one |
Molecular Mass |
192.214 g·mol−1 |
Heat of Formation |
-98.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
1.03 ± 1.08 D |
Volume |
229.57 Å 3 |
Surface Area |
213.15 Å 2 |
HOMO Energy |
-9.29 ± 0.55 eV |
LUMO Energy |
2.11 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- (5s)-1-methyl-5-(1-oxido-3-pyridin-1-iumyl)-2-pyrrolidinone
- (5s)-1-methyl-5-(1-oxidopyridin-1-ium-3-yl)-2-pyrrolidone
- (5s)-1-methyl-5-(1-oxidopyridin-1-ium-3-yl)pyrrolidin-2-one
|
InChIKey |
CIPULDKLIIVIER-VIFPVBQESA-N |
QR Code |
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Links |
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DOI |
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Downloads |
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|
Elements |
H
C
O
N
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