Geometry & MOs

Info

ID:	420279
PubChem CID:	135112216
Reduced:	N2S2O5C15H22 (1)
Stoich.:	A2B2C5D15E22 (1)
Weight, g/mol:	324.241293
ΔH_f, kcal/mol:	-165.25
Dipole, Da:	2.37
IP(EA), eV:	-8.92(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]-2-methyl-2-morpholin-4-ylpropan-1-one

Drug info:

PubChemData

Smile

CN1C[C@H]2CN([C@@H](C1)COC2)S(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)C

DOS

IR

Vibrations