Geometry & MOs

Info

ID:	427735
PubChem CID:	135161825
Reduced:	F2N3O3C20H33 (1)
Stoich.:	A2B3C3D20E33 (1)
Weight, g/mol:	409.294057
ΔH_f, kcal/mol:	-255.07
Dipole, Da:	1.82
IP(EA), eV:	-8.88(0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[4-[formyl-(1-methoxy-3-methylbutan-2-yl)amino]piperidin-1-yl]-6-azaspiro[3.4]octane-6-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)N1CCC2(C1)CC(C2)N3CCC(CC3)N4CC(CC4CO)(F)F

DOS

IR

Vibrations