Geometry & MOs

Info

ID:	247923
PubChem CID:	103077556
Reduced:	BrClFSO2N4H9C10 (1)
Stoich.:	ABCDE2F4G9H10 (1)
Weight, g/mol:	399.96593
ΔH_f, kcal/mol:	-72.3
Dipole, Da:	7.1
IP(EA), eV:	-9.36(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-4-bromo-5-chloro-2-fluoro-N-[(2-hydroxycyclopentyl)methyl]benzenesulfonamide

Drug info:

PubChemData

Smile

C1=C(C(=C(C(=C1Cl)Br)N)F)S(=O)(=O)NCC2=CN=CN2

DOS

IR

Vibrations