Geometry & MOs

Info

ID:	252316
PubChem CID:	103110516
Reduced:	BrFN2O2C13H16 (1)
Stoich.:	ABC2D2E13F16 (1)
Weight, g/mol:	310.054277
ΔH_f, kcal/mol:	-118.4
Dipole, Da:	2.01
IP(EA), eV:	-9.53(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-amino-2-methylphenyl)methyl]-4-chlorobenzenesulfonamide

Drug info:

PubChemData

Smile

CCN(C)C(=O)C(C)NC(=O)C1=C(C=CC(=C1)Br)F

DOS

IR

Vibrations