Geometry & MOs

Info

ID:	356177
PubChem CID:	127291213
Reduced:	SO3N4C19H30 (1)
Stoich.:	AB3C4D19E30 (1)
Weight, g/mol:	396.219512
ΔH_f, kcal/mol:	-108.55
Dipole, Da:	1.06
IP(EA), eV:	-9.05(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-2-[4-[3-(2,2-dimethylpropanoyl)-1,3-thiazolidine-4-carbonyl]piperazin-1-yl]propanamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1CC1)N2CCN(CC2)C(=O)C3CSCN3C(=O)C4CCC4

DOS

IR

Vibrations