Geometry & MOs

Info

ID:	153591
PubChem CID:	56312849
Reduced:	N2F3O3C22H33 (1)
Stoich.:	A2B3C3D22E33 (1)
Weight, g/mol:	351.194677
ΔH_f, kcal/mol:	-281.8
Dipole, Da:	3.57
IP(EA), eV:	-8.81(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[4-(1H-indol-2-yl)piperidin-1-yl]propan-1-one

Drug info:

PubChemData

Smile

CN(CCN(C)C(=O)CCC1=CC(=C(C=C1)OCC(F)(F)F)OC)C2CCCCC2

DOS

IR

Vibrations