Geometry & MOs

Info

ID:	68306
PubChem CID:	46508156
Reduced:	SN3O4H19C23 (1)
Stoich.:	AB3C4D19E23 (1)
Weight, g/mol:	480.19436
ΔH_f, kcal/mol:	-73.88
Dipole, Da:	4.32
IP(EA), eV:	-9.12(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-6-(5-methylthiophen-2-yl)-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=CC=C2NC(=O)COC(=O)CCN3C=NC4=C(C3=O)C=CS4

DOS

IR

Vibrations