Geometry & MOs

Info

ID:	328419
PubChem CID:	126722960
Reduced:	N3O4C19H19 (1)
Stoich.:	A3B4C19D19 (1)
Weight, g/mol:	483.12429
ΔH_f, kcal/mol:	-60.82
Dipole, Da:	6.08
IP(EA), eV:	-9.03(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-bromo-3-(fluoromethyl)-5-methylphenyl]-2,4,6-tri(propan-2-yl)benzenesulfonamide

Drug info:

PubChemData

Smile

CCOC1=C(C=CC(=C1)C)COC2=CC=NN2C3=NC=CC(=C3)C(=O)O

DOS

IR

Vibrations