Geometry & MOs

Info

ID:	175381
PubChem CID:	75894597
Reduced:	ON2F3C18H25 (1)
Stoich.:	AB2C3D18E25 (1)
Weight, g/mol:	379.135448
ΔH_f, kcal/mol:	-216.46
Dipole, Da:	0.67
IP(EA), eV:	-9.49(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-benzothiophene-2-carbonyl)-N-(6-methylpyridin-2-yl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)C(C1=CC=CC=C1)NC(=O)N2CCCC(C2)C(F)(F)F

DOS

IR

Vibrations