Geometry & MOs

Info

ID:	48040
PubChem CID:	10536746
Reduced:	NO4C10H19 (1)
Stoich.:	AB4C10D19 (1)
Weight, g/mol:	217.110279
ΔH_f, kcal/mol:	-196.81
Dipole, Da:	3.53
IP(EA), eV:	-9.94(0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-4-ethyl-1-(4-methoxyphenyl)-3-methylideneazetidin-2-one

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N[C@@H](CO)[C@@H](C=C)O

DOS

IR

Vibrations