Geometry & MOs

Info

ID:	154957
PubChem CID:	56314514
Reduced:	SF2O2N3H17C19 (1)
Stoich.:	AB2C2D3E17F19 (1)
Weight, g/mol:	412.116939
ΔH_f, kcal/mol:	-101.31
Dipole, Da:	8.1
IP(EA), eV:	-8.99(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-fluoro-2-(1-methylimidazol-2-yl)sulfanylphenyl]-2-(5-fluoro-2-methyl-1H-indol-3-yl)acetamide

Drug info:

PubChemData

Smile

CN1C=CN=C1SC2=C(C=C(C=C2)F)NC(=O)CCOC3=CC=C(C=C3)F

DOS

IR

Vibrations