Geometry & MOs

Info

ID:	140774
PubChem CID:	52757613
Reduced:	BrFSN2O3C17H18 (1)
Stoich.:	ABCD2E3F17G18 (1)
Weight, g/mol:	472.146821
ΔH_f, kcal/mol:	-126.91
Dipole, Da:	5.15
IP(EA), eV:	-9.83(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[[4-(4-ethoxyphenoxy)phenyl]sulfonylamino]propyl]-2-fluorobenzamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)S(=O)(=O)NCCCNC(=O)C2=CC=CC=C2F)Br

DOS

IR

Vibrations