Geometry & MOs

Info

ID:	309008
PubChem CID:	126534188
Reduced:	SN4H14C20 (1)
Stoich.:	AB4C14D20 (1)
Weight, g/mol:	313.107593
ΔH_f, kcal/mol:	184.95
Dipole, Da:	3.84
IP(EA), eV:	-8.36(-1.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3Z)-5-pyrazin-2-yl-3-pyrrolo[3,2-b]pyridin-2-ylidene-1,2-dihydropyrazolo[3,4-b]pyridine

Drug info:

PubChemData

Smile

C1=CC2=N/C(=C/3\C=C(NN3)C4=CC=NC=C4)/C=C2C(=C1)C5=CSC=C5

DOS

IR

Vibrations