Geometry & MOs

Info

ID:	246903
PubChem CID:	103065506
Reduced:	ON2S2C14H20 (1)
Stoich.:	AB2C2D14E20 (1)
Weight, g/mol:	322.117356
ΔH_f, kcal/mol:	-23.07
Dipole, Da:	2.37
IP(EA), eV:	-8.68(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-methylthiophen-2-yl)-3-(thiolan-3-yl)-1,3-diazaspiro[4.4]nonan-4-one

Drug info:

PubChemData

Smile

CC(C)C1C(=O)N(C(N1)C2=CSC=C2)C3CCSC3

DOS

IR

Vibrations