Geometry & MOs

Info

ID:	151030
PubChem CID:	53790727
Reduced:	BrOSiC12H25 (1)
Stoich.:	ABCD12E25 (1)
Weight, g/mol:	441.208613
ΔH_f, kcal/mol:	-125.13
Dipole, Da:	1.91
IP(EA), eV:	-9.76(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R)-3-cyclopentyl-4-[(1S)-1-[(2-methylpropan-2-yl)oxy]ethyl]-N-(4-nitronaphthalen-1-yl)-1,3-thiazolidin-2-imine

Drug info:

PubChemData

Smile

CCCCCC(C)(C=CBr)O[Si](C)(C)C

DOS

IR

Vibrations