Geometry & MOs

Info

ID:	56483
PubChem CID:	17435868
Reduced:	ClO2F3N5H17C19 (1)
Stoich.:	AB2C3D5E17F19 (1)
Weight, g/mol:	466.00205
ΔH_f, kcal/mol:	-175.62
Dipole, Da:	6.91
IP(EA), eV:	-8.95(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[2-(5-bromo-2-methoxyphenyl)-1,3-thiazol-4-yl]phenyl]-N-ethylmethanesulfonamide

Drug info:

PubChemData

Smile

C1CN(CCN1CN2C(=O)C3=C(C2=O)C(=CC=C3)N)C4=C(C=C(C=N4)C(F)(F)F)Cl

DOS

IR

Vibrations