Geometry & MOs

Info

ID:	690
PubChem CID:	3205
Reduced:	SN4O6C22H30 (1)
Stoich.:	AB4C6D22E30 (1)
Weight, g/mol:	478.188606
ΔH_f, kcal/mol:	-202.36
Dipole, Da:	4.33
IP(EA), eV:	-9.52(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[2-[2-[(2-amino-3-phenylpropanoyl)amino]ethoxy]ethoxy]ethyl]-4-sulfamoylbenzamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CC(C(=O)NCCOCCOCCNC(=O)C2=CC=C(C=C2)S(=O)(=O)N)N

DOS

IR

Vibrations