Geometry & MOs

Info

ID:	158499
PubChem CID:	56464099
Reduced:	SO3N4C26H36 (1)
Stoich.:	AB3C4D26E36 (1)
Weight, g/mol:	395.140055
ΔH_f, kcal/mol:	-93.89
Dipole, Da:	7.12
IP(EA), eV:	-8.36(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-acetamido-5-methylphenyl)-1-(3-chlorophenyl)-2,5-dimethylpyrrole-3-carboxamide

Drug info:

PubChemData

Smile

CN1CCN(CC1)CC(C2=CC=CC=C2)NC(=O)CCNS(=O)(=O)C3=CC4=C(CCCC4)C=C3

DOS

IR

Vibrations