Geometry & MOs

Info

ID:	155118
PubChem CID:	56320711
Reduced:	SN3O3H21C22 (1)
Stoich.:	AB3C3D21E22 (1)
Weight, g/mol:	427.129884
ΔH_f, kcal/mol:	-47.65
Dipole, Da:	3.68
IP(EA), eV:	-9.06(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[3-[5-(4-chlorophenyl)-1,3-oxazol-2-yl]propanoylamino]propyl]-3-hydroxybenzamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)SC2=C(C=CC=N2)C(=O)NCCCNC(=O)C3=CC(=CC=C3)O

DOS

IR

Vibrations