Geometry & MOs

Info

ID:	448066
PubChem CID:	135288143
Reduced:	N9H23C30 (1)
Stoich.:	A9B23C30 (1)
Weight, g/mol:	410.106214
ΔH_f, kcal/mol:	270.9
Dipole, Da:	11.47
IP(EA), eV:	-8.73(-2.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(3Z)-3-(4-thiophen-2-ylimidazo[4,5-c]pyridin-2-ylidene)-1,2-dihydropyrazolo[4,3-b]pyridin-5-yl]pyridin-3-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CNCC2=CC(=CN=C2)C3=NC\4=C(C=C3)NN/C4=C\5/N=C6C=CN=C(C6=N5)C7=CC=NC=C7

DOS

IR

Vibrations