Geometry & MOs

Info

ID:	167608
PubChem CID:	74846900
Reduced:	Cl2O3N4H24C25 (1)
Stoich.:	A2B3C4D24E25 (1)
Weight, g/mol:	472.13584
ΔH_f, kcal/mol:	-54.44
Dipole, Da:	7.95
IP(EA), eV:	-8.96(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[5-(methoxymethyl)-3-oxo-2-phenyl-1H-pyrazol-4-yl]methylidene]-3-[[4-(trifluoromethyl)phenyl]methyl]imidazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC(C)C1=C(C(=O)N(N1)C2=CC(=C(C=C2)Cl)Cl)C=C3C(=O)N(C(=O)N3)CCCC4=CC=CC=C4

DOS

IR

Vibrations