Geometry & MOs

Info

ID:	242737
PubChem CID:	99205916
Reduced:	FSN4O4C23H27 (1)
Stoich.:	ABC4D4E23F27 (1)
Weight, g/mol:	424.04563
ΔH_f, kcal/mol:	-139.12
Dipole, Da:	12.37
IP(EA), eV:	-9.0(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-2-methyl-N-[(4-morpholin-4-ylphenyl)methyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CN(CCCCCC1=CC(=NN1)C2=CC(=CC=C2)F)S(=O)(=O)C3=CC(=C(C=C3)OC)C(=O)N

DOS

IR

Vibrations