Geometry & MOs

Info

ID:	65437
PubChem CID:	29214974
Reduced:	SO2N7C23H23 (1)
Stoich.:	AB2C7D23E23 (1)
Weight, g/mol:	355.167811
ΔH_f, kcal/mol:	90.85
Dipole, Da:	5.94
IP(EA), eV:	-8.86(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-butyl-1-[[2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)acetyl]amino]-1-methylthiourea

Drug info:

PubChemData

Smile

CCOC1=CC=CC(=C1)NC(=O)CSC2=NN=C(N2N)N/N=C\C3=CC=CC4=CC=CC=C43

DOS

IR

Vibrations