Geometry & MOs

Info

ID:	357204
PubChem CID:	127293708
Reduced:	SN2O3C20H22 (1)
Stoich.:	AB2C3D20E22 (1)
Weight, g/mol:	337.179027
ΔH_f, kcal/mol:	-87.59
Dipole, Da:	3.31
IP(EA), eV:	-8.42(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dihydro-1-benzofuran-5-yl)-1-(pyridin-4-ylmethyl)piperidine-2-carboxamide

Drug info:

PubChemData

Smile

C1CC(C2=C(C1)OC=C2)NC(=O)CCC(=O)N3CCSC4=CC=CC=C43

DOS

IR

Vibrations