Geometry & MOs

Info

ID:	155028
PubChem CID:	56314643
Reduced:	FSO3N4H19C20 (1)
Stoich.:	ABC3D4E19F20 (1)
Weight, g/mol:	435.116524
ΔH_f, kcal/mol:	-94.5
Dipole, Da:	6.42
IP(EA), eV:	-9.24(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-fluoro-2-(1-methylimidazol-2-yl)sulfanylphenyl]-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(N=C(C=C1)C(=O)NC2=C(C=CC(=C2)F)SC3=NC=CN3C)C

DOS

IR

Vibrations