Geometry & MOs

Info

ID:	228227
PubChem CID:	87563699
Reduced:	ClSO2N4H13C15 (1)
Stoich.:	ABC2D4E13F15 (1)
Weight, g/mol:	518.357356
ΔH_f, kcal/mol:	10.16
Dipole, Da:	8.06
IP(EA), eV:	-8.97(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S,6Z)-1-[tert-butyl(dimethyl)silyl]oxy-6-[(R)-tert-butylsulfinyl]iminohexan-2-yl]-(2,2,5-trimethylhexan-3-yl)carbamic acid

Drug info:

PubChemData

Smile

CN1C=NC=C1C2=CC(=C(N=C2)Cl)NS(=O)(=O)C3=CC=CC=C3

DOS

IR

Vibrations