Geometry & MOs

Info

ID:	213523
PubChem CID:	81064007
Reduced:	SCl2N2O3C13H20 (1)
Stoich.:	AB2C2D3E13F20 (1)
Weight, g/mol:	382.05619
ΔH_f, kcal/mol:	-119.9
Dipole, Da:	3.73
IP(EA), eV:	-9.39(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-(2-ethoxyethyl)-N-methyl-5-(propylaminomethyl)furan-3-sulfonamide

Drug info:

PubChemData

Smile

CCOCCN(C)S(=O)(=O)C1=C(C=C(C(=C1)CNC)Cl)Cl

DOS

IR

Vibrations