Geometry & MOs

Info

ID:	154786
PubChem CID:	56314311
Reduced:	FN2O2C26H35 (1)
Stoich.:	AB2C2D26E35 (1)
Weight, g/mol:	482.144234
ΔH_f, kcal/mol:	-160.83
Dipole, Da:	3.93
IP(EA), eV:	-9.39(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-3-(2,6-dimethylmorpholin-4-yl)sulfonyl-N-[2-(2-fluorophenyl)-2-methylpropyl]benzamide

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)C1CCCN1C(=O)C23CC4CC(C2)CC(C4)C3)C5=CC=CC=C5F

DOS

IR

Vibrations