Geometry & MOs

Info

ID:	152385
PubChem CID:	56311300
Reduced:	O2N3C21H29 (1)
Stoich.:	A2B3C21D29 (1)
Weight, g/mol:	427.210721
ΔH_f, kcal/mol:	-59.43
Dipole, Da:	6.58
IP(EA), eV:	-8.76(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methoxy-4-nitrophenyl)-3-[4-[(4-methoxyphenyl)methyl]piperidin-1-yl]propanamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CC2CCN(CC2)CC(=O)NC3(CCCC3)C#N

DOS

IR

Vibrations