Geometry & MOs

Info

ID:	273435
PubChem CID:	103771115
Reduced:	ClNSO2C13H18 (1)
Stoich.:	ABCD2E13F18 (1)
Weight, g/mol:	290.174276
ΔH_f, kcal/mol:	-76.4
Dipole, Da:	2.46
IP(EA), eV:	-9.43(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxy-4-methylpentyl)-1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide

Drug info:

PubChemData

Smile

CC(C)CC(CNC(=O)/C=C/C1=CC=C(S1)Cl)O

DOS

IR

Vibrations