Geometry & MOs

Info

ID:	392693
PubChem CID:	135017686
Reduced:	ON4H14C21 (1)
Stoich.:	AB4C14D21 (1)
Weight, g/mol:	327.147058
ΔH_f, kcal/mol:	147.28
Dipole, Da:	4.79
IP(EA), eV:	-9.29(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R,4S)-1-benzyl-4-[(3,5-dimethoxyphenyl)methyl]-3-hydroxyazetidin-2-one

Drug info:

PubChemData

Smile

[C-]#[N+]/C(=C(/CC1C2=CC=CC=C2OC(=C1C#N)N)\C3=CC=CC=C3)/C#N

DOS

IR

Vibrations