Geometry & MOs

Info

ID:	413479
PubChem CID:	135086428
Reduced:	NSCl3O8C33H34 (1)
Stoich.:	ABC3D8E33F34 (1)
Weight, g/mol:	180.034193
ΔH_f, kcal/mol:	-267.84
Dipole, Da:	5.0
IP(EA), eV:	-8.26(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC(=O)OCC1C(C(C(C(O1)OC(=N)C(Cl)(Cl)Cl)O[C@H](CSC2=CC=CC=C2)C3=CC=CC=C3)OC(=O)C)OCC4=CC=CC=C4

DOS

IR

Vibrations