Geometry & MOs

Info

ID:	337284
PubChem CID:	127256966
Reduced:	NO3C10H17 (1)
Stoich.:	AB3C10D17 (1)
Weight, g/mol:	291.183444
ΔH_f, kcal/mol:	-135.15
Dipole, Da:	4.63
IP(EA), eV:	-9.11(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-ethyl-4-oxocyclohexa-1,5-dien-1-yl)propan-2-yl piperidine-3-carboxylate

Drug info:

PubChemData

Smile

CCC(C=O)OC(=O)C1CCCNC1

DOS

IR

Vibrations