Geometry & MOs

Info

ID:	369059
PubChem CID:	127331191
Reduced:	OSN5C17H21 (1)
Stoich.:	ABC5D17E21 (1)
Weight, g/mol:	354.140199
ΔH_f, kcal/mol:	18.54
Dipole, Da:	4.94
IP(EA), eV:	-8.76(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dihydro-1-benzothiophen-3-yl)-4-(4-hydroxyphenyl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CN1C=NN=C1C2CCN(CC2)C(=O)NC3CSC4=CC=CC=C34

DOS

IR

Vibrations