Geometry & MOs

Info

ID:	402947
PubChem CID:	135057996
Reduced:	NB2O6C24H39 (1)
Stoich.:	AB2C6D24E39 (1)
Weight, g/mol:	464.097089
ΔH_f, kcal/mol:	-423.91
Dipole, Da:	5.05
IP(EA), eV:	-8.41(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-acetyl-2-morpholin-4-yl-N-[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]benzamide

Drug info:

PubChemData

Smile

B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC(=C2CN(C)C)B3OC(C(O3)(C)C)(C)C)C(=O)OCC

DOS

IR

Vibrations