Geometry & MOs

Info

ID:	82338
PubChem CID:	49855907
Reduced:	O2N7H11C15 (1)
Stoich.:	A2B7C11D15 (1)
Weight, g/mol:	493.181313
ΔH_f, kcal/mol:	72.61
Dipole, Da:	8.38
IP(EA), eV:	-9.01(-1.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4Z)-5-[4-(1,1-difluoroethoxy)phenyl]-4-[hydroxy-(4-propan-2-ylphenyl)methylidene]-1-(6-methylpyridazin-3-yl)pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

C1=CC(=O)N(C=C1)C2=C(C=NN2)NC(=O)C3=C4N=CC=CN4N=C3

DOS

IR

Vibrations