Geometry & MOs

Info

ID:	159887
PubChem CID:	57288856
Reduced:	O4N7C26H27 (1)
Stoich.:	A4B7C26D27 (1)
Weight, g/mol:	492.940223
ΔH_f, kcal/mol:	-43.6
Dipole, Da:	4.03
IP(EA), eV:	-8.55(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[6-chloro-5-(2,4,6-trichlorophenoxy)pyrimidin-4-yl]-2,4-dimethylbenzenesulfonamide

Drug info:

PubChemData

Smile

CC(C(CN(C)C1=CC=C(C=C1)C(=N)N)C(=O)O)N(C2=CN=CC=C2)C(=O)OC3=CC4=C(C=C3)N=CN4

DOS

IR

Vibrations