Geometry & MOs

Info

ID:	391583
PubChem CID:	135006695
Reduced:	PRbSSeO6C22H38 (1)
Stoich.:	ABCDE6F22G38 (1)
Weight, g/mol:	402.2341
ΔH_f, kcal/mol:	-274.59
Dipole, Da:	8.02
IP(EA), eV:	-7.46(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(R)-N-[(1R,2R)-2-[benzyl(hydroxy)amino]-3-methyl-1-(4-methylphenyl)butyl]-2-methylpropane-2-sulfinamide

Drug info:

PubChemData

Smile

CC(C)(C)P(=[Se])(C1=CC=CC=C1)[S-].C1COCCOCCOCCOCCOCCO1.[Rb+]

DOS

IR

Vibrations