Geometry & MOs

Info

ID:	152421
PubChem CID:	56311347
Reduced:	ON4C23H26 (1)
Stoich.:	AB4C23D26 (1)
Weight, g/mol:	463.192963
ΔH_f, kcal/mol:	42.96
Dipole, Da:	2.36
IP(EA), eV:	-8.06(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[[2-[4-(2,5-dimethylphenoxy)piperidin-1-yl]acetyl]amino]phenyl]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2N=C1CN3CCC(CC3)C4=CNC5=C4C=C(C=C5)OC

DOS

IR

Vibrations