Geometry & MOs

Info

ID:	309887
PubChem CID:	126564789
Reduced:	O2F3N4C23H25 (1)
Stoich.:	A2B3C4D23E25 (1)
Weight, g/mol:	423.155606
ΔH_f, kcal/mol:	-187.66
Dipole, Da:	4.66
IP(EA), eV:	-8.27(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-methyl-4-[(3E)-3-(4-pyridin-3-ylimidazo[4,5-c]pyridin-2-ylidene)-1,2-dihydropyrazolo[4,3-b]pyridin-5-yl]pyrazol-3-yl]methanol

Drug info:

PubChemData

Smile

CC(C1=CN(C2=C1C=C(C=C2)O)C)C(=O)NCC3=C(N=C(C=C3)C(F)(F)F)N4CCCC4

DOS

IR

Vibrations