Geometry & MOs

Info

ID:

448128

PubChem CID:

135288675

Reduced:

N3O6C25H33 (1)

Stoich.:

A3B6C25D33 (1)

Weight, g/mol:

549.205928

ΔHf, kcal/mol:

-275.56

Dipole, Da:

9.23

IP(EA), eV:

 -8.5(-0.14)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[5-[(3Z)-3-[4-(5-methylthiophen-2-yl)imidazo[4,5-c]pyridin-2-ylidene]-1,2-dihydropyrazolo[4,3-b]pyridin-5-yl]pyridin-3-yl]-2-piperidin-4-ylacetamide

Drug info:

PubChemData

Smile

C[C@@H](C(=O)NCC1=CC=CC2=CC=CC=C21)NC(=O)CC(CCC(=O)O)NC(=O)OC(C)(C)C

DOS

IR

Vibrations