Geometry & MOs

Info

ID:

444150

PubChem CID:

135261476

Reduced:

OSN7H27C30 (1)

Stoich.:

ABC7D27E30 (1)

Weight, g/mol:

418.137594

ΔHf, kcal/mol:

150.8

Dipole, Da:

9.34

IP(EA), eV:

 -8.55(-2.12)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(3Z)-3-[4-(5-fluorothiophen-2-yl)pyrrolo[3,2-c]pyridin-2-ylidene]-5-piperidin-4-yl-1,2-dihydropyrazolo[3,4-c]pyridine

Drug info:

PubChemData

Smile

C1CCC(CC1)CC(=O)NC2=CN=CC(=C2)C3=NC=C4C(=C3)/C(=C/5\C=C6C(=N5)C=CN=C6C7=CSC=C7)/NN4

DOS

IR

Vibrations