Geometry & MOs

Info

ID:	418445
PubChem CID:	135104822
Reduced:	SO2N4C16H20 (1)
Stoich.:	AB2C4D16E20 (1)
Weight, g/mol:	357.141008
ΔH_f, kcal/mol:	-40.01
Dipole, Da:	3.66
IP(EA), eV:	-9.07(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R,5R)-7-(3-fluoro-4-methoxyphenyl)sulfonyl-4-methoxy-7-azaspiro[4.5]decane

Drug info:

PubChemData

Smile

C1[C@H]([C@H](CN1C(=O)CCC2=CSC(=N2)N)O)CC3=CC=NC=C3

DOS

IR

Vibrations