N-[(Z)-2H-Pyrrol-2-Ylidenemethyl]-2-Pyrimidinamine

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Properties Simple | Detailed

Formula C9H8N4
IUPAC Name n-[(z)-pyrrol-2-ylidenemethyl]pyrimidin-2-amine
Molecular Mass 172.187 g·mol−1
Heat of Formation 425.2 ± 16.7 kJ·mol−1
Dipole Moment 3.56 ± 1.08 D
Volume 204.1 Å 3
Surface Area 207.74 Å 2
HOMO Energy -8.84 ± 0.55 eV
LUMO Energy -1.40 ± eV
Point Group Symmetry Cs
Synonyms
  • 2-pyriidinamine, n-(1h-pyrrol-2-ylmethylene)-
  • n-[(z)-2-pyrrolylidenemethyl]-2-pyrimidinamine
  • n-pmd-2-nh2pyr
  • pyrimidin-2-yl-[(z)-pyrrol-2-ylidenemethyl]amine
CAS Number(s)
  • 146882-33-9
InChIKey ATHJFIDJKVLFIF-FPLPWBNLSA-N
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DOI
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Elements H C N