Geometry & MOs

Info

ID:	414952
PubChem CID:	135087932
Reduced:	FN3O3C20H24 (1)
Stoich.:	AB3C3D20E24 (1)
Weight, g/mol:	359.095807
ΔH_f, kcal/mol:	-145.22
Dipole, Da:	4.21
IP(EA), eV:	-8.8(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-(2-chlorophenyl)sulfonyl-4-methyl-1-oxa-9-azaspiro[5.5]undecan-4-ol

Drug info:

PubChemData

Smile

CN1CCC[C@]2([C@H]1CN(CC2)C(=O)C3=CC4=C(N3C)C=CC(=C4)F)C(=O)O

DOS

IR

Vibrations