Geometry & MOs

Info

ID:	81202
PubChem CID:	49854459
Reduced:	SN4O5C24H24 (1)
Stoich.:	AB4C5D24E24 (1)
Weight, g/mol:	494.162391
ΔH_f, kcal/mol:	-69.6
Dipole, Da:	6.5
IP(EA), eV:	-9.16(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(1-methoxypropan-2-yloxy)-2-[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)phenoxy]-N-(1,3-thiazol-2-yl)benzamide

Drug info:

PubChemData

Smile

CCC1=NN=C(O1)C2=CC=C(C=C2)OC3=C(C=C(C=C3)OC(C)COC)C(=O)NC4=NC=CS4

DOS

IR

Vibrations