Geometry & MOs

Info

ID:	149752
PubChem CID:	53789428
Reduced:	PSN2F3O3C9H16 (1)
Stoich.:	ABC2D3E3F9G16 (1)
Weight, g/mol:	519.99561
ΔH_f, kcal/mol:	-365.61
Dipole, Da:	5.97
IP(EA), eV:	-10.07(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-(4-bromo-2-methylphenoxy)-2-chloro-3,6-dimethylphenyl]carbamoyl]-2-chlorobenzamide

Drug info:

PubChemData

Smile

CCC(C)SP(=O)(N(C)C=O)N(C)C(=O)C(F)(F)F

DOS

IR

Vibrations