Geometry & MOs

Info

ID:	155145
PubChem CID:	56320807
Reduced:	ISN2O5C14H19 (1)
Stoich.:	ABC2D5E14F19 (1)
Weight, g/mol:	428.151826
ΔH_f, kcal/mol:	-158.32
Dipole, Da:	5.43
IP(EA), eV:	-8.77(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-methyl-1,2-oxazol-3-yl)-2-[2-[2-[2-(4-methylphenyl)-1,3-oxazol-4-yl]ethylamino]-2-oxoethyl]sulfanylpropanamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C(=C1)C(=O)N2CCN(CC2)S(=O)(=O)C)I)OC

DOS

IR

Vibrations