Geometry & MOs

Info

ID:	245557
PubChem CID:	99453866
Reduced:	FN3O3H18C21 (1)
Stoich.:	AB3C3D18E21 (1)
Weight, g/mol:	413.186318
ΔH_f, kcal/mol:	-52.39
Dipole, Da:	7.61
IP(EA), eV:	-8.76(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-[2-(2-fluorophenyl)-5-methylpyrazol-3-yl]butanamide

Drug info:

PubChemData

Smile

CC1=NN(C(=C1)NC(=O)/C=C/C2=CC3=C(C=C2)OCCO3)C4=CC=CC=C4F

DOS

IR

Vibrations