Geometry & MOs

Info

ID:	141109
PubChem CID:	52820028
Reduced:	FSN3O3C23H30 (1)
Stoich.:	ABC3D3E23F30 (1)
Weight, g/mol:	376.07864
ΔH_f, kcal/mol:	-147.91
Dipole, Da:	3.0
IP(EA), eV:	-8.54(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[(2-bromophenyl)methyl]piperidin-4-yl]-3-methylfuran-2-carboxamide

Drug info:

PubChemData

Smile

CCCN1CCC(CC1)CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)NC3=CC=C(C=C3)F)C

DOS

IR

Vibrations