Geometry & MOs

Info

ID:	120870
PubChem CID:	50747588
Reduced:	SN3O4C12H15 (1)
Stoich.:	AB3C4D12E15 (1)
Weight, g/mol:	444.146741
ΔH_f, kcal/mol:	-80.52
Dipole, Da:	4.76
IP(EA), eV:	-9.79(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[[4-ethoxy-3-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)phenyl]sulfonylamino]phenyl]acetamide

Drug info:

PubChemData

Smile

CC(C)C1=NOC(=N1)C2=C(C=CC(=C2)S(=O)(=O)N)OC

DOS

IR

Vibrations