Geometry & MOs

Info

ID:	308918
PubChem CID:	126531859
Reduced:	N9H21C22 (1)
Stoich.:	A9B21C22 (1)
Weight, g/mol:	412.176007
ΔH_f, kcal/mol:	208.41
Dipole, Da:	6.3
IP(EA), eV:	-8.15(-2.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN1CCN(CC1)C2=NC=CC3=N/C(=C/4\C5=C(C=CC(=N5)C6=CN=CC=C6)NN4)/N=C32

DOS

IR

Vibrations