Geometry & MOs

Info

ID:	363826
PubChem CID:	127313483
Reduced:	O3N4C18H26 (1)
Stoich.:	A3B4C18D26 (1)
Weight, g/mol:	354.172562
ΔH_f, kcal/mol:	-93.25
Dipole, Da:	6.91
IP(EA), eV:	-8.81(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[4-(cyclobutanecarbonyl)piperazin-1-yl]ethyl]-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide

Drug info:

PubChemData

Smile

COC1=NC=C(C=C1)C(=O)NCCN2CCN(CC2)C(=O)C3CCC3

DOS

IR

Vibrations