N-Phenyl-2-[(E)-2H-Pyrrol-2-Ylidenemethyl]Hydrazinecarboxamide

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Properties Simple | Detailed

Formula C12H13N4O
IUPAC Name 1-phenyl-3-(pyrrol-1-ium-2-ylmethylamino)urea
Molecular Mass 229.258 g·mol−1
Heat of Formation 286.5 ± 16.7 kJ·mol−1
Dipole Moment 4.67 ± 1.08 D
Volume 272.33 Å 3
Surface Area 266.23 Å 2
HOMO Energy -9.04 ± 0.55 eV
LUMO Energy -0.98 ± eV
Point Group Symmetry C1
Synonyms
  • 1-phenyl-3-(2-pyrrolylidenemethylamino)urea
  • 1-phenyl-3-(pyrrol-2-ylidenemethylamino)urea
  • 1-phenyl-3-[[(e)-2-pyrrolylidenemethyl]amino]urea
  • 1-phenyl-3-[[(e)-pyrrol-2-ylidenemethyl]amino]urea
InChIKey STFFGKCREKBHDZ-PKNBQFBNSA-N
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