Geometry & MOs

Info

ID:	420948
PubChem CID:	135115112
Reduced:	SN2O6C16H22 (1)
Stoich.:	AB2C6D16E22 (1)
Weight, g/mol:	368.209993
ΔH_f, kcal/mol:	-219.84
Dipole, Da:	5.07
IP(EA), eV:	-9.2(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6,7-dimethoxy-1'-[(5-methylpyridin-2-yl)methyl]spiro[3,4-dihydroisochromene-1,4'-piperidine]

Drug info:

PubChemData

Smile

CN(C)S(=O)(=O)C[C@@H]1COC[C@H]1NC(=O)C2=C3C(=CC=C2)OCCO3

DOS

IR

Vibrations