Geometry & MOs

Info

ID:	381807
PubChem CID:	134972638
Reduced:	NSO3H21C26 (1)
Stoich.:	ABC3D21E26 (1)
Weight, g/mol:	505.192934
ΔH_f, kcal/mol:	-24.21
Dipole, Da:	5.85
IP(EA), eV:	-9.01(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-6-(1,3-benzothiazol-2-ylsulfanyl)hexan-2-yl]oxy-tert-butyl-diphenylsilane

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N2CC3=CC4=CC=CC=C4C(=C3C(=O)C2)C5=CC=CC=C5

DOS

IR

Vibrations