Geometry & MOs

Info

ID:	66035
PubChem CID:	46488221
Reduced:	SN4O4H20C21 (1)
Stoich.:	AB4C4D20E21 (1)
Weight, g/mol:	415.156577
ΔH_f, kcal/mol:	-54.62
Dipole, Da:	7.52
IP(EA), eV:	-9.0(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[2-[(5Z)-5-benzylidene-2,4-dioxo-1,3-thiazolidin-3-yl]ethylamino]-1-oxopropan-2-yl]cyclopentanecarboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CS(=O)(=O)CC3=CC=C(C=C3)C#N

DOS

IR

Vibrations