Geometry & MOs

Info

ID:	308822
PubChem CID:	126522805
Reduced:	NO2C18H25 (1)
Stoich.:	AB2C18D25 (1)
Weight, g/mol:	527.243359
ΔH_f, kcal/mol:	-67.51
Dipole, Da:	2.81
IP(EA), eV:	-8.77(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclohexyl-N-[5-[(3E)-3-(4-pyridin-2-ylpyrrolo[2,3-b]pyridin-2-ylidene)-1,2-dihydroindazol-5-yl]pyridin-3-yl]acetamide

Drug info:

PubChemData

Smile

CC(C)OC(=O)C1(CCC=CC1N(C)C)C2=CC=CC=C2

DOS

IR

Vibrations