Geometry & MOs

Info

ID:	413225
PubChem CID:	135086171
Reduced:	NO2C19H19 (1)
Stoich.:	AB2C19D19 (1)
Weight, g/mol:	287.152144
ΔH_f, kcal/mol:	-22.67
Dipole, Da:	4.05
IP(EA), eV:	-8.79(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (3E)-3-benzylidene-2-oxopiperidine-1-carboxylate

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)/C=C/2\CCN(C2=O)CC3=CC=CC=C3

DOS

IR

Vibrations