Geometry & MOs

Info

ID:	191068
PubChem CID:	78101488
Reduced:	SF3N3O4C19H24 (1)
Stoich.:	AB3C3D4E19F24 (1)
Weight, g/mol:	429.191323
ΔH_f, kcal/mol:	-292.35
Dipole, Da:	7.19
IP(EA), eV:	-9.36(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

acetic acid;2-(4,5-dihydro-1H-imidazol-2-yl)-7-[6-(4,5-dihydro-1H-imidazol-2-yl)indol-2-ylidene]-1H-imidazo[1,2-a]pyridine

Drug info:

PubChemData

Smile

CC(C)C(C(=O)NC1=CC(=C(C=C1)F)C2(CS(=O)(=O)C3(CCOC3)C(=N2)N)C)(F)F

DOS

IR

Vibrations