Geometry & MOs

Info

ID:	133327
PubChem CID:	51508908
Reduced:	FN3O4H26C28 (1)
Stoich.:	AB3C4D26E28 (1)
Weight, g/mol:	391.112781
ΔH_f, kcal/mol:	-130.14
Dipole, Da:	6.81
IP(EA), eV:	-8.38(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

[(2R,6R)-2,6-dimethylmorpholin-4-yl]-[4-(4-fluorophenyl)sulfonyliminocyclohexa-2,5-dien-1-ylidene]methanolate

Drug info:

PubChemData

Smile

CCN(C1=CC=CC=C1)C(=O)COC(=O)[C@H](CC2=CNC3=CC=CC=C32)NC(=O)C4=CC=C(C=C4)F

DOS

IR

Vibrations