Geometry & MOs

Info

ID:	376608
PubChem CID:	134222629
Reduced:	NC24H27 (1)
Stoich.:	AB24C27 (1)
Weight, g/mol:	497.157143
ΔH_f, kcal/mol:	39.04
Dipole, Da:	1.81
IP(EA), eV:	-8.16(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)NC

DOS

IR

Vibrations