Geometry & MOs

Info

ID:	56909
PubChem CID:	22394856
Reduced:	SN3O7C20H29 (1)
Stoich.:	AB3C7D20E29 (1)
Weight, g/mol:	469.188272
ΔH_f, kcal/mol:	-274.94
Dipole, Da:	4.34
IP(EA), eV:	-8.94(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3,4-dihydroxy-1-(4-hydroxyphenyl)nonan-2-yl]-2-[methyl(methylsulfonyl)amino]-1,3-oxazole-4-carboxamide

Drug info:

PubChemData

Smile

CCCCCC(C(C(CC1=CC=C(C=C1)O)NC(=O)C2=COC(=N2)NS(=O)(=O)C)O)O

DOS

IR

Vibrations