Geometry & MOs

Info

ID:

376436

PubChem CID:

134222449

Reduced:

FO3N11H24C30 (1)

Stoich.:

AB3C11D24E30 (1)

Weight, g/mol:

606.195086

ΔHf, kcal/mol:

62.88

Dipole, Da:

5.88

IP(EA), eV:

 -9.17(-1.5)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[2-[2-[[1-(3,5-difluorophenyl)-5-oxopyrrolidin-3-yl]carbamoyl]-4-fluoropyrrolidin-1-yl]-2-oxoethyl]-5-pyridazin-4-ylindazole-3-carboxamide

Drug info:

PubChemData

Smile

C1C(CN(C1C(=O)NC2=CN3C(=NC(=N3)C4=CC=CC=C4)N=C2)C(=O)CN5C6=C(C=C(C=C6)C7=CN=NC=C7)C(=N5)C(=O)N)F

DOS

IR

Vibrations