Geometry & MOs

Info

ID:	153761
PubChem CID:	56313072
Reduced:	FN3O3C25H26 (1)
Stoich.:	AB3C3D25E26 (1)
Weight, g/mol:	350.195405
ΔH_f, kcal/mol:	-59.34
Dipole, Da:	5.39
IP(EA), eV:	-8.78(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[2-(3,5-dimethyl-1,2-oxazol-4-yl)propanoyl]piperazin-1-yl]-2-oxo-N-propan-2-ylacetamide

Drug info:

PubChemData

Smile

CN(C)C(CNC(=O)/C=C/C1=CC(=C(C=C1)OC2=CN=CC=C2)F)C3=CC=CC=C3OC

DOS

IR

Vibrations