Geometry & MOs

Info

ID:	152378
PubChem CID:	56311293
Reduced:	N2O3C26H34 (1)
Stoich.:	A2B3C26D34 (1)
Weight, g/mol:	452.267508
ΔH_f, kcal/mol:	-95.02
Dipole, Da:	0.78
IP(EA), eV:	-8.62(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-2-[4-[(4-methoxyphenyl)methyl]piperidin-1-yl]ethanone

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CC2CCN(CC2)CC(=O)N3CCCC3C4=CC(=CC=C4)OC

DOS

IR

Vibrations