Geometry & MOs

Info

ID:	184659
PubChem CID:	77190001
Reduced:	ClSO3N4C23H33 (1)
Stoich.:	ABC3D4E23F33 (1)
Weight, g/mol:	444.219512
ΔH_f, kcal/mol:	-118.36
Dipole, Da:	7.95
IP(EA), eV:	-8.7(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[2-(3-benzyl-1,3-thiazolidin-2-ylidene)hydrazinyl]-4-methyl-1,2-dioxopentan-3-yl]cyclohexanecarboxamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)C(=O)NN=C1N(CCS1)CC2=CC=CC=C2)NC(=O)C3CCCCC3.Cl

DOS

IR

Vibrations