Geometry & MOs

Info

ID:	154772
PubChem CID:	56314294
Reduced:	FOSN4C18H19 (1)
Stoich.:	ABCD4E18F19 (1)
Weight, g/mol:	432.184921
ΔH_f, kcal/mol:	-0.59
Dipole, Da:	6.14
IP(EA), eV:	-9.22(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[[2-(2-fluorophenyl)-2-methylpropyl]carbamoyl]phenyl]-2,3-dihydro-1-benzofuran-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)C1=CSC(=N1)C2=CN(N=C2)C)C3=CC=CC=C3F

DOS

IR

Vibrations