Geometry & MOs

Info

ID:	318401
PubChem CID:	126651121
Reduced:	N2O2C11H16 (1)
Stoich.:	A2B2C11D16 (1)
Weight, g/mol:	502.168619
ΔH_f, kcal/mol:	-68.25
Dipole, Da:	4.55
IP(EA), eV:	-9.32(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-4-[6-[2-fluoro-4-[2-(1-methylazetidin-3-yl)ethynyl]phenyl]-3-oxo-1H-pyrrolo[1,2-c]imidazol-2-yl]-N-hydroxy-2-methyl-2-methylsulfonylbutanamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=C(C=CC(=C1)C(=O)NN)O

DOS

IR

Vibrations