Geometry & MOs

Info

ID:	417422
PubChem CID:	135093628
Reduced:	ClFON4C19H20 (1)
Stoich.:	ABCD4E19F20 (1)
Weight, g/mol:	307.189592
ΔH_f, kcal/mol:	-54.43
Dipole, Da:	1.96
IP(EA), eV:	-9.12(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-morpholin-4-yl-1-[2-(5-propan-2-yl-1,2-oxazol-3-yl)pyrrolidin-1-yl]ethanone

Drug info:

PubChemData

Smile

C1CC2(CCC3=CN=C(N=C32)N)CN(C1)C(=O)CC4=C(C=C(C=C4)F)Cl

DOS

IR

Vibrations