Geometry & MOs

Info

ID:	181597
PubChem CID:	76764764
Reduced:	FCl2O3H11C15 (1)
Stoich.:	AB2C3D11E15 (1)
Weight, g/mol:	351.168188
ΔH_f, kcal/mol:	-145.84
Dipole, Da:	3.98
IP(EA), eV:	-9.51(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

prop-2-enyl 2-[2-(3-methoxy-2-oxocyclohexyl)-4-oxo-3-propan-2-ylazetidin-1-yl]-2-oxoacetate

Drug info:

PubChemData

Smile

CC(C(=O)O)OC1=C(C=C(C=C1)F)C2=C(C=C(C=C2)Cl)Cl

DOS

IR

Vibrations