Geometry & MOs

Info

ID:	259805
PubChem CID:	103175166
Reduced:	SO2N3C14H15 (1)
Stoich.:	AB2C3D14E15 (1)
Weight, g/mol:	275.107692
ΔH_f, kcal/mol:	1.45
Dipole, Da:	2.66
IP(EA), eV:	-8.65(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-(chloromethyl)-3-methylphenoxy]-2-ethyl-6-methylpyridine

Drug info:

PubChemData

Smile

CCC1=C(C=CC(=N1)C)OC2=C(N3C=CSC3=N2)CO

DOS

IR

Vibrations