Geometry & MOs

Info

ID:	156686
PubChem CID:	56371697
Reduced:	F2N3O4C20H23 (1)
Stoich.:	A2B3C4D20E23 (1)
Weight, g/mol:	437.02964
ΔH_f, kcal/mol:	-216.43
Dipole, Da:	2.31
IP(EA), eV:	-9.27(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-bromophenyl)sulfonyl-N-(2,3-dihydro-1-benzofuran-2-ylmethyl)-2-methylpropanamide

Drug info:

PubChemData

Smile

COCCN(CC(F)F)C(=O)C1=CC(=CC=C1)N2C(=O)C3CC=CCC3C(=O)N2

DOS

IR

Vibrations