Geometry & MOs

Info

ID:	435232
PubChem CID:	135185595
Reduced:	SN2O4C19H34 (1)
Stoich.:	AB2C4D19E34 (1)
Weight, g/mol:	386.223929
ΔH_f, kcal/mol:	-218.62
Dipole, Da:	2.34
IP(EA), eV:	-8.23(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (4E)-4-[(R)-tert-butylsulfinyl]imino-3-(hydroxymethyl)-8-azaspiro[4.5]decane-8-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCC\2(CCC(/C2=N\S(=O)C(C)(C)C)CO)CC1

DOS

IR

Vibrations