Geometry & MOs

Info

ID:	154893
PubChem CID:	56314439
Reduced:	BrFSN2O3C19H22 (1)
Stoich.:	ABCD2E3F19G22 (1)
Weight, g/mol:	420.148535
ΔH_f, kcal/mol:	-130.36
Dipole, Da:	3.54
IP(EA), eV:	-8.85(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2-fluorophenyl)-2-methylpropyl]-2-(furan-2-ylmethyl)-1,3-dioxoisoindole-5-carboxamide

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)C1=CC(=C(C=C1)Br)S(=O)(=O)N(C)C)C2=CC=CC=C2F

DOS

IR

Vibrations