Formula |
C16H15N3O4 |
IUPAC Name |
(4-methoxycarbonylphenyl) 4-guanidinobenzoate |
Molecular Mass |
313.308 g·mol−1 |
Heat of Formation |
-422.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
6.96 ± 1.08 D |
Volume |
357.23 Å 3 |
Surface Area |
337.25 Å 2 |
HOMO Energy |
-9.20 ± 0.55 eV |
LUMO Energy |
-0.88 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (4-methoxycarbonylphenyl) 4-(diaminomethylideneamino)benzoate
- 4'-carbomethoxyphenyl 4-guanidinobenzoate
- 4'-cmgb
- 4-guanidinobenzoic acid (4-carbomethoxyphenyl) ester
- 4-guanidinobenzoic acid (4-methoxycarbonylphenyl) ester
- benzoic acid, 4-((aminoimimomethyl)amino)-, 4-(methoxycarbonyl)phenyl ester
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InChIKey |
NIBWPUGZCXNNPC-UHFFFAOYSA-N |
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Links |
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Elements |
H
C
O
N
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