Geometry & MOs

Info

ID:	82346
PubChem CID:	49855918
Reduced:	SO3N5H27C33 (1)
Stoich.:	AB3C5D27E33 (1)
Weight, g/mol:	368.144868
ΔH_f, kcal/mol:	48.48
Dipole, Da:	4.97
IP(EA), eV:	-9.06(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-fluoroanilino)-2-(4-fluorophenyl)-8,8-dimethyl-5,7-dihydroimidazo[1,2-a]pyrazin-6-one

Drug info:

PubChemData

Smile

C1CC1NC(=O)C2=CC3=C(S2)C4=CC=CC=C4N(CC3)C(=O)C5=CC=C(C=C5)NC(=O)C6=CC=NN6C7=CC=CC=C7

DOS

IR

Vibrations