Geometry & MOs
Info
ID: |
134355 |
PubChem CID: |
51685466 |
Reduced: |
ClN7C22H25 (1) |
Stoich.: |
AB7C22D25 (1) |
Weight, g/mol: |
286.131742 |
ΔHf, kcal/mol: |
141.76 |
Dipole, Da: |
7.95 |
IP(EA), eV: |
0.0(0.0) |
Spin(Sz, S2): |
0.500000, 0.809813 |
Charge, e: |
0 |
Chem-info
IUPAC name:
(2R)-1-[(2-phenyl-1,3-oxazol-4-yl)methyl]piperidine-2-carboxylic acid