Geometry & MOs

Info

ID:	175734
PubChem CID:	75942454
Reduced:	SN2O2C26H35 (1)
Stoich.:	AB2C2D26E35 (1)
Weight, g/mol:	432.219512
ΔH_f, kcal/mol:	-48.16
Dipole, Da:	1.08
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 1.060355
Charge, e:	0

Chem-info

IUPAC name:

2-(6-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-[[1-(thiophen-2-ylmethyl)piperidin-4-yl]methyl]acetamide

Drug info:

PubChemData

Smile

C1CCC[NH+](CC1)CC2=CC=CC(=C2)CNC(=O)C3=CC=CC=C3SCC4CCCO4

DOS

IR

Vibrations