Geometry & MOs

Info

ID:	60650
PubChem CID:	26697340
Reduced:	SBr2N2O3C17H22 (1)
Stoich.:	AB2C2D3E17F22 (1)
Weight, g/mol:	341.06266
ΔH_f, kcal/mol:	-111.68
Dipole, Da:	7.64
IP(EA), eV:	-8.91(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-N-cyclopentyl-5-ethoxy-4-methoxybenzamide

Drug info:

PubChemData

Smile

C1CCC(C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)Br)Br

DOS

IR

Vibrations