Geometry & MOs

Info

ID:	133498
PubChem CID:	51536619
Reduced:	FO2N3H16C19 (1)
Stoich.:	AB2C3D16E19 (1)
Weight, g/mol:	406.136257
ΔH_f, kcal/mol:	-44.58
Dipole, Da:	3.8
IP(EA), eV:	-8.94(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]sulfonyl-N-(4-fluoro-2-methylphenyl)benzamide

Drug info:

PubChemData

Smile

C1COC2=CC=CC=C2[C@H]1NC(=O)C3=C(NN=C3)C4=CC=C(C=C4)F

DOS

IR

Vibrations