Geometry & MOs

Info

ID:	151885
PubChem CID:	56310709
Reduced:	SN3O3C24H27 (1)
Stoich.:	AB3C3D24E27 (1)
Weight, g/mol:	439.167811
ΔH_f, kcal/mol:	-53.57
Dipole, Da:	5.72
IP(EA), eV:	-8.26(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[[2-[[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]amino]acetyl]amino]phenyl]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CN(CCCC1=CC=C(C=C1)OC)CC(=O)NC2=CC=C(C=C2)NC(=O)C3=CC=CS3

DOS

IR

Vibrations