Geometry & MOs

Info

ID:	158280
PubChem CID:	56463286
Reduced:	FSN3O6H18C22 (1)
Stoich.:	ABC3D6E18F22 (1)
Weight, g/mol:	424.123898
ΔH_f, kcal/mol:	-186.94
Dipole, Da:	6.69
IP(EA), eV:	-8.86(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-3-[[[4-methyl-2-(2-methylpropyl)-1,3-thiazole-5-carbonyl]amino]carbamoyl]benzenesulfonamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)/C=C/C(=O)O)S(=O)(=O)NC2=C(C=CC(=C2)F)NC(=O)C3=CC=CC=N3

DOS

IR

Vibrations