Geometry & MOs

Info

ID:	376604
PubChem CID:	134222625
Reduced:	N3H13C14 (1)
Stoich.:	A3B13C14 (1)
Weight, g/mol:	506.182629
ΔH_f, kcal/mol:	94.17
Dipole, Da:	4.81
IP(EA), eV:	-8.94(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[4-fluoro-2-[hydroxy-[(2-oxo-1H-pyridin-3-yl)amino]methyl]pyrrolidin-1-yl]-2-oxoethyl]-5-pyridazin-4-ylindazole-3-carboxamide

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)N2C3=CC=CC=C3N=N2

DOS

IR

Vibrations