Geometry & MOs

Info

ID:	349119
PubChem CID:	127274845
Reduced:	O2S2N5C15H17 (1)
Stoich.:	A2B2C5D15E17 (1)
Weight, g/mol:	395.141596
ΔH_f, kcal/mol:	6.43
Dipole, Da:	5.83
IP(EA), eV:	-8.99(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-3-(3-methyl-1-phenylpyrazolo[3,4-b]pyridine-6-carbonyl)-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

CN(C)C(=O)C1CSCN1C(=O)CC2=CSC(=N2)C3=NC=CN=C3

DOS

IR

Vibrations