Geometry & MOs

Info

ID:	141263
PubChem CID:	52850302
Reduced:	ClSN2O2C23H23 (1)
Stoich.:	ABC2D2E23F23 (1)
Weight, g/mol:	372.128549
ΔH_f, kcal/mol:	-34.67
Dipole, Da:	4.68
IP(EA), eV:	-9.42(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-acetamido-4,5-difluorophenyl)-3,4,7-trimethyl-1-benzofuran-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)CC2=CC=CC=C2)C(=O)NC3(CCOCC3)C4=CC=C(C=C4)Cl

DOS

IR

Vibrations