Geometry & MOs

Info

ID:	277499
PubChem CID:	103829019
Reduced:	BrFSN2O2C13H18 (1)
Stoich.:	ABCD2E2F13G18 (1)
Weight, g/mol:	366.04129
ΔH_f, kcal/mol:	-108.46
Dipole, Da:	3.4
IP(EA), eV:	-9.43(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-amino-2,4-dimethylpentan-2-yl)-4-bromo-3-fluorobenzenesulfonamide

Drug info:

PubChemData

Smile

CC1CCCN(C1CN)S(=O)(=O)C2=CC(=C(C=C2)Br)F

DOS

IR

Vibrations