Geometry & MOs

Info

ID:	368563
PubChem CID:	127329466
Reduced:	SO3N5C19H21 (1)
Stoich.:	AB3C5D19E21 (1)
Weight, g/mol:	379.105371
ΔH_f, kcal/mol:	-72.24
Dipole, Da:	5.69
IP(EA), eV:	-9.61(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,1-dioxothian-3-yl)-3-fluoro-4-(4-fluoro-2-methylphenyl)benzamide

Drug info:

PubChemData

Smile

C1CN(CCC1C2=NC(=CS2)C3=CC=NC=C3)C(=O)CN4CCC(=O)NC4=O

DOS

IR

Vibrations