Geometry & MOs

Info

ID:	70524
PubChem CID:	48413469
Reduced:	O3N4C21H30 (1)
Stoich.:	A3B4C21D30 (1)
Weight, g/mol:	407.268511
ΔH_f, kcal/mol:	-80.47
Dipole, Da:	3.29
IP(EA), eV:	-8.61(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-(diethylamino)pentan-2-yl]-1,3-dimethyl-6-phenylpyrazolo[3,4-b]pyridine-4-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)CCCC(C)NC(=O)C1=C(NN=C1)C2=CC3=C(C=C2)OCCO3

DOS

IR

Vibrations