Geometry & MOs

Info

ID:	56907
PubChem CID:	22394841
Reduced:	NO2C14H23 (1)
Stoich.:	AB2C14D23 (1)
Weight, g/mol:	459.113393
ΔH_f, kcal/mol:	-92.9
Dipole, Da:	2.98
IP(EA), eV:	-9.58(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3,4-dihydroxy-1-(4-hydroxyphenyl)-6-methylsulfanylhexan-2-yl]-2-(methanesulfonamido)-1,3-oxazole-4-carboxamide

Drug info:

PubChemData

Smile

CCCCC(C(CNCC1=CC=CC=C1)O)O

DOS

IR

Vibrations