Geometry & MOs

Info

ID:	235952
PubChem CID:	92711134
Reduced:	FN3O4H20C24 (1)
Stoich.:	AB3C4D20E24 (1)
Weight, g/mol:	403.13322
ΔH_f, kcal/mol:	-79.19
Dipole, Da:	5.14
IP(EA), eV:	-9.07(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(S)-(2-fluorophenyl)-(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-3-methoxybenzamide

Drug info:

PubChemData

Smile

COC1=CC(=CC(=C1)C(=O)N[C@@H](C2=CC=CC=C2F)C3=NN=C(O3)C4=CC=CC=C4)OC

DOS

IR

Vibrations