Geometry & MOs

Info

ID:	448034
PubChem CID:	135287854
Reduced:	ClFO2N4H20C23 (1)
Stoich.:	ABC2D4E20F23 (1)
Weight, g/mol:	395.095315
ΔH_f, kcal/mol:	-13.65
Dipole, Da:	5.94
IP(EA), eV:	-9.88(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1([C@H]2CC[C@]1(C3=NN=C(C=C23)C4=C(C=CC=C4Cl)F)C5=NC(=NC=C5)C(=O)OC)C

DOS

IR

Vibrations