Geometry & MOs

Info

ID:	331364
PubChem CID:	127248771
Reduced:	FSO3N5C18H24 (1)
Stoich.:	ABC3D5E18F24 (1)
Weight, g/mol:	437.189689
ΔH_f, kcal/mol:	-95.06
Dipole, Da:	4.16
IP(EA), eV:	-8.58(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(dimethylamino)-5-(4-fluorophenyl)pyrimidin-4-yl]-N,N-diethylmorpholine-4-sulfonamide

Drug info:

PubChemData

Smile

CN(C)C1=NC=C(C(=N1)C2CN(CCO2)S(=O)(=O)N(C)C)C3=CC(=CC=C3)F

DOS

IR

Vibrations