Geometry & MOs

Info

ID:	318931
PubChem CID:	126653762
Reduced:	NO4C11H17 (1)
Stoich.:	AB4C11D17 (1)
Weight, g/mol:	405.18009
ΔH_f, kcal/mol:	-178.06
Dipole, Da:	7.1
IP(EA), eV:	-10.2(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 2-[3-acetyl-5-(3-methylimidazo[4,5-b]pyridin-6-yl)indazol-1-yl]acetate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1C2C[C@@H]2CC1C(=O)O

DOS

IR

Vibrations