Geometry & MOs

Info

ID:

443889

PubChem CID:

135260300

Reduced:

FN7H26C30 (1)

Stoich.:

AB7C26D30 (1)

Weight, g/mol:

412.176007

ΔHf, kcal/mol:

160.52

Dipole, Da:

5.81

IP(EA), eV:

 -8.7(-2.14)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-(dimethylamino)-N-[5-[(3E)-3-pyrrolo[3,2-c]pyridin-2-ylidene-1,2-dihydropyrazolo[4,3-b]pyridin-5-yl]pyridin-3-yl]acetamide

Drug info:

PubChemData

Smile

C1CCN(CC1)CC2=CC(=CN=C2)C3=NC\4=C(C=C3)NN/C4=C/5\C=C6C(=N5)C=CN=C6C7=CC(=CC=C7)F

DOS

IR

Vibrations