Geometry & MOs

Info

ID:	420153
PubChem CID:	135111429
Reduced:	SN3O5C18H23 (1)
Stoich.:	AB3C5D18E23 (1)
Weight, g/mol:	364.251464
ΔH_f, kcal/mol:	-162.08
Dipole, Da:	3.74
IP(EA), eV:	-9.2(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]methyl]-N-methyl-N-phenylaniline

Drug info:

PubChemData

Smile

CN(C)S(=O)(=O)C[C@@H]1CN(C[C@H]1O)C(=O)C2=CC(=NC3=CC=CC=C32)OC

DOS

IR

Vibrations