Geometry & MOs

Info

ID:	190126
PubChem CID:	77957993
Reduced:	OSN4C20H20 (1)
Stoich.:	ABC4D20E20 (1)
Weight, g/mol:	429.246141
ΔH_f, kcal/mol:	55.9
Dipole, Da:	8.0
IP(EA), eV:	-9.57(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-[4-(2,6-dimethylmorpholin-4-yl)-3-fluoroanilino]pentyl]-2-methylpropane-2-sulfonamide

Drug info:

PubChemData

Smile

CC1C(=O)N(C(CC1(C)C2=CC(=CS2)C3=CC(=CC(=C3)C#N)C#N)N)C

DOS

IR

Vibrations