Geometry & MOs

Info

ID:	247934
PubChem CID:	103077622
Reduced:	BrClFSO2N4C11H11 (1)
Stoich.:	ABCDE2F4G11H11 (1)
Weight, g/mol:	388.9248
ΔH_f, kcal/mol:	-58.12
Dipole, Da:	5.71
IP(EA), eV:	-9.18(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-amino-4-bromo-5-chloro-2-fluorophenyl)sulfonylamino]ethyl carbamate

Drug info:

PubChemData

Smile

CN1C=CC(=N1)CNS(=O)(=O)C2=CC(=C(C(=C2F)N)Br)Cl

DOS

IR

Vibrations