Geometry & MOs

Info

ID:	317538
PubChem CID:	126643182
Reduced:	NO3C9H10 (2)
Stoich.:	AB3C9D10 (2)
Weight, g/mol:	349.117489
ΔH_f, kcal/mol:	-241.97
Dipole, Da:	3.59
IP(EA), eV:	-10.01(-1.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-acetyl-5-(2-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)indazol-1-yl]acetic acid

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CC[C@H]([C@H]1C(=O)O)N2C(=O)C3=CC=CC=C3C2=O

DOS

IR

Vibrations