Geometry & MOs

Info

ID:	263866
PubChem CID:	103402810
Reduced:	ClS2N3O3C12H14 (1)
Stoich.:	AB2C3D3E12F14 (1)
Weight, g/mol:	229.167794
ΔH_f, kcal/mol:	-65.8
Dipole, Da:	7.36
IP(EA), eV:	-9.33(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-(2-methoxyethoxy)propoxymethyl]-1,2,3,6-tetrahydropyridine

Drug info:

PubChemData

Smile

CC1=CSC(=C1Cl)C2=NN=C(N2CCOC)SCC(=O)O

DOS

IR

Vibrations