Geometry & MOs

Info

ID:	73794
PubChem CID:	48420452
Reduced:	NSO5C21H21 (1)
Stoich.:	ABC5D21E21 (1)
Weight, g/mol:	361.131408
ΔH_f, kcal/mol:	-110.71
Dipole, Da:	6.83
IP(EA), eV:	-9.66(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-O-(1,2-diphenylethyl) 2-O-methyl pyridine-2,6-dicarboxylate

Drug info:

PubChemData

Smile

CN(C)S(=O)(=O)C1=CC=C(O1)C(=O)OC(CC2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations