Geometry & MOs

Info

ID:	156292
PubChem CID:	56369986
Reduced:	BrClSN4O4C16H18 (1)
Stoich.:	ABCD4E4F16G18 (1)
Weight, g/mol:	426.12665
ΔH_f, kcal/mol:	-83.57
Dipole, Da:	3.72
IP(EA), eV:	-9.53(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-1-ethyl-N-(4-heptyl-4-methyl-2,5-dioxoimidazolidin-1-yl)pyrrole-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)S(=O)(=O)N2CCCN(CC2)C(=O)C3=C(N=CC(=C3)Br)Cl

DOS

IR

Vibrations