Geometry & MOs

Info

ID:	81104
PubChem CID:	49854356
Reduced:	SN4O5C26H26 (1)
Stoich.:	AB4C5D26E26 (1)
Weight, g/mol:	462.136176
ΔH_f, kcal/mol:	-69.39
Dipole, Da:	5.38
IP(EA), eV:	-9.04(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(COC)OC1=CC(=CC(=C1)OC2=CC=C(C=C2)C3=NN=C(O3)C4CCC4)C(=O)NC5=NC=CS5

DOS

IR

Vibrations