Geometry & MOs

Info

ID:

448177

PubChem CID:

135289043

Reduced:

FON6H25C31 (1)

Stoich.:

ABC6D25E31 (1)

Weight, g/mol:

485.196408

ΔHf, kcal/mol:

93.66

Dipole, Da:

13.06

IP(EA), eV:

 -8.48(-1.93)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[5-[(3Z)-3-(4-pyridin-4-ylpyrrolo[3,2-c]pyridin-2-ylidene)-1,2-dihydroindazol-5-yl]pyridin-3-yl]cyclobutanecarboxamide

Drug info:

PubChemData

Smile

C1CCC(C1)C(=O)NC2=CN=CC(=C2)C3=CC\4=C(C=C3)NN/C4=C\5/C=C6C(=N5)C=CN=C6C7=CC(=CC=C7)F

DOS

IR

Vibrations