Geometry & MOs

Info

ID:	177222
PubChem CID:	76147759
Reduced:	NO2F3C16H20 (1)
Stoich.:	AB2C3D16E20 (1)
Weight, g/mol:	340.189926
ΔH_f, kcal/mol:	-238.19
Dipole, Da:	4.8
IP(EA), eV:	-9.93(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-morpholin-4-ylpyrimidin-4-yl)methyl]-2-phenylbutanamide

Drug info:

PubChemData

Smile

CC(CNC(=O)CCC1=CC=C(C=C1)C(F)(F)F)(C2CC2)O

DOS

IR

Vibrations