Geometry & MOs

Info

ID:	328171
PubChem CID:	126692916
Reduced:	N2F3H5C7 (2)
Stoich.:	A2B3C5D7 (2)
Weight, g/mol:	665.141202
ΔH_f, kcal/mol:	-215.94
Dipole, Da:	4.19
IP(EA), eV:	-9.04(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-difluoro-N-[2-fluoro-5-[5-[2-[(4-methylsulfonylcyclohexyl)amino]pyrimidin-4-yl]-2-propan-2-yl-1,3-thiazol-4-yl]phenyl]benzenesulfonamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C2=CC=C(N3C2=NC(N3)N)C(F)(F)F)C(F)(F)F

DOS

IR

Vibrations