Geometry & MOs

Info

ID:	364686
PubChem CID:	127315981
Reduced:	SO2N3C21H31 (1)
Stoich.:	AB2C3D21E31 (1)
Weight, g/mol:	371.187878
ΔH_f, kcal/mol:	-85.98
Dipole, Da:	5.22
IP(EA), eV:	-8.96(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-methylbutan-2-yl)-3-(4-morpholin-4-yl-4-oxobutanoyl)-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)C(C)NC(=O)C1CSCN1C(=O)C2=CC=CC(=C2)CN3CCCC3

DOS

IR

Vibrations