Geometry & MOs

Info

ID:	130484
PubChem CID:	51090943
Reduced:	FN2O3C19H25 (1)
Stoich.:	AB2C3D19E25 (1)
Weight, g/mol:	326.199428
ΔH_f, kcal/mol:	-153.37
Dipole, Da:	9.26
IP(EA), eV:	-9.11(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-methyl-1-benzofuran-2-yl)-(4-piperidin-1-ylpiperidin-1-yl)methanone

Drug info:

PubChemData

Smile

CC(C1=C(C=CC(=C1)F)OC)NC(=O)C2CCCN(C2)C(=O)C3CC3

DOS

IR

Vibrations