Geometry & MOs

Info

ID:	156429
PubChem CID:	56370558
Reduced:	NOC6H7 (4)
Stoich.:	ABC6D7 (4)
Weight, g/mol:	427.235873
ΔH_f, kcal/mol:	-77.66
Dipole, Da:	5.88
IP(EA), eV:	-8.33(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3,5-dimethoxy-4-methylphenyl)-[2-[2-(3,4-dimethoxyphenyl)ethyl]piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)CCC2CCCCN2C(=O)CN3C(=O)C4=CC=CC=C4N=N3)OC

DOS

IR

Vibrations