Geometry & MOs

Info

ID:	81016
PubChem CID:	49854256
Reduced:	SN4O5C24H24 (1)
Stoich.:	AB4C5D24E24 (1)
Weight, g/mol:	494.162391
ΔH_f, kcal/mol:	-78.52
Dipole, Da:	5.97
IP(EA), eV:	-9.0(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1-methoxy-3-methylbutan-2-yl)oxy-5-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenoxy]-N-(1,3-thiazol-2-yl)benzamide

Drug info:

PubChemData

Smile

CCC(COC)OC1=CC(=CC(=C1)OC2=CC=C(C=C2)C3=NN=C(O3)C)C(=O)NC4=NC=CS4

DOS

IR

Vibrations