Geometry & MOs

Info

ID:	155817
PubChem CID:	56367662
Reduced:	SF2N2O5C21H24 (1)
Stoich.:	AB2C2D5E21F24 (1)
Weight, g/mol:	370.06922
ΔH_f, kcal/mol:	-264.83
Dipole, Da:	10.6
IP(EA), eV:	-9.27(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(3-bromo-5-fluorobenzoyl)piperidin-3-yl]butanamide

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1OC(F)F)C(=O)NCC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

DOS

IR

Vibrations