Geometry & MOs

Info

ID:	341367
PubChem CID:	127264060
Reduced:	SN2O5C22H40 (1)
Stoich.:	AB2C5D22E40 (1)
Weight, g/mol:	388.239579
ΔH_f, kcal/mol:	-286.33
Dipole, Da:	3.69
IP(EA), eV:	-8.56(0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (2S,4R)-4-(tert-butylsulfinylamino)-2-methoxy-8-azaspiro[4.5]decane-8-carboxylate

Drug info:

PubChemData

Smile

CC(C)C(=O)O[C@@H]1C[C@H](C2(C1)CCN(CC2)C(=O)OC(C)(C)C)NS(=O)C(C)(C)C

DOS

IR

Vibrations