Geometry & MOs

Info

ID:	69215
PubChem CID:	46530465
Reduced:	FO2N4C25H25 (1)
Stoich.:	AB2C4D25E25 (1)
Weight, g/mol:	446.243024
ΔH_f, kcal/mol:	-42.12
Dipole, Da:	3.92
IP(EA), eV:	-8.65(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]-1,6-di(propan-2-yl)pyrazolo[3,4-b]pyridine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(N1C2=CC=C(C=C2)F)C)C(=O)NC(C3=CC=C(C=C3)OC)C4=NC=CN4C

DOS

IR

Vibrations