Geometry & MOs

Info

ID:	318426
PubChem CID:	126651346
Reduced:	FINOC12H13 (1)
Stoich.:	ABCDE12F13 (1)
Weight, g/mol:	432.146741
ΔH_f, kcal/mol:	-16.33
Dipole, Da:	1.49
IP(EA), eV:	-9.54(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1C(CO1)N2CC(C2)(C3=CC=C(C=C3)I)F

DOS

IR

Vibrations