Geometry & MOs

Info

ID:	27200
PubChem CID:	819482
Reduced:	NO4H17C18 (1)
Stoich.:	AB4C17D18 (1)
Weight, g/mol:	275.090606
ΔH_f, kcal/mol:	-114.88
Dipole, Da:	4.18
IP(EA), eV:	-9.61(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4,6-dimethoxypyrimidin-2-yl)oxy-6-methylpyridine-2-carbaldehyde

Drug info:

PubChemData

Smile

C1N([C@@H](C(=O)O1)CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

DOS

IR

Vibrations