Geometry & MOs

Info

ID:	157198
PubChem CID:	56422386
Reduced:	SN3O5C19H19 (1)
Stoich.:	AB3C5D19E19 (1)
Weight, g/mol:	471.176976
ΔH_f, kcal/mol:	-144.6
Dipole, Da:	3.53
IP(EA), eV:	-9.37(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-benzyl-N-[4-(furan-3-carbonylamino)-2-(trifluoromethyl)phenyl]piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CCC(C(=O)N)SC1=NC2=C(C=CC(=C2)C(=O)OC)C(=O)N1CC3=CC=CO3

DOS

IR

Vibrations