Geometry & MOs

Info

ID:	56925
PubChem CID:	22394897
Reduced:	NF2O3H9C10 (1)
Stoich.:	AB2C3D9E10 (1)
Weight, g/mol:	409.105605
ΔH_f, kcal/mol:	-187.76
Dipole, Da:	2.38
IP(EA), eV:	-10.09(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-cyano-3,4-dihydroxy-1-pyridin-4-ylpentan-2-yl)-2-(methanesulfonamido)-1,3-oxazole-4-carboxamide

Drug info:

PubChemData

Smile

C1=C(C=C(C=C1F)F)COC(=O)NCC=O

DOS

IR

Vibrations