Geometry & MOs

Info

ID:	298791
PubChem CID:	117656860
Reduced:	OSBr2N2F6H6C10 (1)
Stoich.:	ABC2D2E6F6G10 (1)
Weight, g/mol:	409.003023
ΔH_f, kcal/mol:	-295.96
Dipole, Da:	5.29
IP(EA), eV:	-9.24(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2,4-dichloro-5-(2,2,2-trifluoroethylsulfinyl)phenyl]-N'-methylpyridine-3-carboximidamide

Drug info:

PubChemData

Smile

C1=C(C(=CC(=C1S(=O)CC(F)(F)F)Br)Br)N=C(C(F)(F)F)N

DOS

IR

Vibrations