Geometry & MOs

Info

ID:	136718
PubChem CID:	52089079
Reduced:	FN2O3C24H25 (1)
Stoich.:	AB2C3D24E25 (1)
Weight, g/mol:	408.184921
ΔH_f, kcal/mol:	-106.53
Dipole, Da:	3.75
IP(EA), eV:	-9.12(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-[[(2R)-oxolan-2-yl]methyl]propanamide

Drug info:

PubChemData

Smile

C1C[C@H](OC1)CN(CC2=CC=CC=C2)C(=O)CCC3=NC=C(O3)C4=CC=C(C=C4)F

DOS

IR

Vibrations