Geometry & MOs

Info

ID:	306132
PubChem CID:	125001705
Reduced:	OSN5C15H17 (1)
Stoich.:	ABC5D15E17 (1)
Weight, g/mol:	419.16452
ΔH_f, kcal/mol:	71.19
Dipole, Da:	3.13
IP(EA), eV:	-9.17(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[6-[(2S)-4-[2-(4-fluorophenyl)acetyl]morpholin-2-yl]pyridin-2-yl]benzamide

Drug info:

PubChemData

Smile

C1COC[C@H](N1CC2=C(NN=C2)C3=CC=CS3)C4=CC=NN4

DOS

IR

Vibrations