Geometry & MOs

Info

ID:	55360
PubChem CID:	17395288
Reduced:	O2N3H11C16 (1)
Stoich.:	A2B3C11D16 (1)
Weight, g/mol:	441.081698
ΔH_f, kcal/mol:	56.9
Dipole, Da:	8.41
IP(EA), eV:	-9.36(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-4-[(5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methoxy]-N-phenylbenzenesulfonamide

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)C#N)COC2=CC=C(C=C2)C3=NN=CO3

DOS

IR

Vibrations