Geometry & MOs

Info

ID:	159697
PubChem CID:	57288639
Reduced:	O11C12H24 (1)
Stoich.:	A11B12C24 (1)
Weight, g/mol:	304.105922
ΔH_f, kcal/mol:	-509.58
Dipole, Da:	3.42
IP(EA), eV:	-10.27(0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-formyl-3-methoxycarbonyl-6-methyl-4-pyridin-4-yl-2,3,4,5-tetrahydropyridine-5-carboxylic acid

Drug info:

PubChemData

Smile

C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)C([C@H]([C@H]([C@@H]([C@H](CO)O)O)O)O)O)O)O)O)O

DOS

IR

Vibrations