Geometry & MOs

Info

ID:	329226
PubChem CID:	126732624
Reduced:	SO2H3C5F9 (1)
Stoich.:	AB2C3D5E9 (1)
Weight, g/mol:	380.351512
ΔH_f, kcal/mol:	-532.73
Dipole, Da:	3.26
IP(EA), eV:	-12.66(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[1-(7-tert-butyl-2-oxa-7-azaspiro[3.4]octan-3-yl)-2-methylpropan-2-yl]piperazin-1-yl]-N,N-dimethylethanamine

Drug info:

PubChemData

Smile

CC(C(C(F)(F)S(=O)(=O)F)(F)F)(C(F)(F)F)F

DOS

IR

Vibrations