Geometry & MOs

Info

ID:	154469
PubChem CID:	56313912
Reduced:	ClSF2N2O2H21C23 (1)
Stoich.:	ABC2D2E2F21G23 (1)
Weight, g/mol:	371.189672
ΔH_f, kcal/mol:	-133.01
Dipole, Da:	5.66
IP(EA), eV:	-9.0(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2-fluorophenyl)-2-methylpropyl]-3,6,6-trimethyl-4-oxo-5,7-dihydro-1-benzofuran-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(SC(=C1)NC(=O)C2=C(C=C(C=C2)F)Cl)C(=O)NCC(C)(C)C3=CC=CC=C3F

DOS

IR

Vibrations