Geometry & MOs

Info

ID:	285970
PubChem CID:	104142564
Reduced:	ClN3C16H22 (1)
Stoich.:	AB3C16D22 (1)
Weight, g/mol:	295.053069
ΔH_f, kcal/mol:	21.13
Dipole, Da:	1.6
IP(EA), eV:	-8.99(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(chloromethyl)-2-[(2-chlorophenyl)methoxy]-6-ethylpyridine

Drug info:

PubChemData

Smile

CCCC1=NC(=CC(=C1)CCl)N2C(=CC(=N2)CC)CC

DOS

IR

Vibrations