Geometry & MOs

Info

ID:	61380
PubChem CID:	26708746
Reduced:	BrFSN3O3C19H23 (1)
Stoich.:	ABCD3E3F19G23 (1)
Weight, g/mol:	463.214092
ΔH_f, kcal/mol:	-123.86
Dipole, Da:	7.96
IP(EA), eV:	-9.03(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-(diethylsulfamoyl)-2-(dimethylamino)phenyl]-3-(3,5-dimethoxyphenyl)propanamide

Drug info:

PubChemData

Smile

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N(C)C)NC(=O)C2=C(C=C(C=C2)Br)F

DOS

IR

Vibrations