Geometry & MOs

Info

ID:	398308
PubChem CID:	135032766
Reduced:	ClN2O2H13C20 (1)
Stoich.:	AB2C2D13E20 (1)
Weight, g/mol:	365.256609
ΔH_f, kcal/mol:	57.79
Dipole, Da:	2.57
IP(EA), eV:	-8.85(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 2-[3-[(3S)-1,4-dioxaspiro[4.5]decan-3-yl]propylidene]piperidine-1-carboxylate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=NN=C(O2)/C=C/C3=CC=C(O3)C4=CC=C(C=C4)Cl

DOS

IR

Vibrations