Geometry & MOs

Info

ID:	430061
PubChem CID:	135170118
Reduced:	N3O3C23H39 (1)
Stoich.:	A3B3C23D39 (1)
Weight, g/mol:	405.27399
ΔH_f, kcal/mol:	-90.04
Dipole, Da:	2.75
IP(EA), eV:	-8.67(0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[1-[6-[ethoxy(hydroxy)methyl]-6-azaspiro[3.4]octan-2-yl]piperidin-4-yl]imidazol-1-yl]-N-methylacetamide

Drug info:

PubChemData

Smile

CCOC1(CO1)N2CCC3(C2)CC(C3)N4CCC(=CC4)[C@@H]5CCCN5CCOC

DOS

IR

Vibrations