Geometry & MOs

Info

ID:

448185

PubChem CID:

135289083

Reduced:

FSN6H23C31 (1)

Stoich.:

ABC6D23E31 (1)

Weight, g/mol:

476.196074

ΔHf, kcal/mol:

183.71

Dipole, Da:

6.26

IP(EA), eV:

 -8.39(-1.91)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[5-[(3Z)-3-[4-(furan-3-yl)pyrrolo[3,2-c]pyridin-2-ylidene]-1,2-dihydroindazol-5-yl]pyridin-3-yl]-3-methylbutanamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CNCC2=CC(=CN=C2)C3=CC\4=C(C=C3)NN/C4=C\5/C=C6C(=N5)C=CN=C6C7=CC=C(S7)F

DOS

IR

Vibrations