Geometry & MOs

Info

ID:	69354
PubChem CID:	46530810
Reduced:	SF2N3O3C18H23 (1)
Stoich.:	AB2C3D3E18F23 (1)
Weight, g/mol:	362.144199
ΔH_f, kcal/mol:	-188.34
Dipole, Da:	5.37
IP(EA), eV:	-9.45(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(3,4-difluorophenyl)ethyl]-1-(furan-2-carbonyl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)S(=O)(=O)C1=CN(C(=C1)C(=O)NC(C)C2=CC(=C(C=C2)F)F)C

DOS

IR

Vibrations