Geometry & MOs

Info

ID:	66577
PubChem CID:	46504837
Reduced:	BrSN2O3F6H15C19 (1)
Stoich.:	ABC2D3E6F15G19 (1)
Weight, g/mol:	418.05619
ΔH_f, kcal/mol:	-389.05
Dipole, Da:	10.67
IP(EA), eV:	-9.28(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-(3-ethoxypropyl)-1-propanoyl-2,3-dihydroindole-6-sulfonamide

Drug info:

PubChemData

Smile

CCC(=O)N1CCC2=CC(=C(C=C21)S(=O)(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)Br

DOS

IR

Vibrations