Geometry & MOs

Info

ID:	322532
PubChem CID:	126670413
Reduced:	N2F3O3C21H31 (1)
Stoich.:	A2B3C3D21E31 (1)
Weight, g/mol:	372.098918
ΔH_f, kcal/mol:	-296.29
Dipole, Da:	4.06
IP(EA), eV:	-9.51(0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-4-[(1E,3E)-4-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-1-(methylideneamino)penta-1,3-dienoxy]benzonitrile

Drug info:

PubChemData

Smile

CC(C)(C)C(=O)O[C@H]1C2CC3CC(C1N(C3)C(=O)CC(F)(F)F)C2NCC4CC4

DOS

IR

Vibrations