Geometry & MOs

Info

ID:	262562
PubChem CID:	103301322
Reduced:	SO2N4C11H20 (1)
Stoich.:	AB2C4D11E20 (1)
Weight, g/mol:	343.96598
ΔH_f, kcal/mol:	-48.85
Dipole, Da:	4.06
IP(EA), eV:	-8.89(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-bromo-4-methoxyphenyl)-(2,4,5-trifluorophenyl)methanone

Drug info:

PubChemData

Smile

CC(C)(C)CN(C)S(=O)(=O)C1=C(C=CC=N1)NN

DOS

IR

Vibrations