Geometry & MOs

Info

ID:	449319
PubChem CID:	135297586
Reduced:	OF2N6C27H28 (1)
Stoich.:	AB2C6D27E28 (1)
Weight, g/mol:	482.249333
ΔH_f, kcal/mol:	-32.07
Dipole, Da:	5.22
IP(EA), eV:	-9.55(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[(2S)-2-[4-butan-2-yl-6-(2,6-difluorophenyl)pyridazin-3-yl]-3-methylbutan-2-yl]-N-(2-hydroxyethyl)pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CCC(C1=CC(=NN=C1C(C)C2=NC(=NC=C2)C3=CNC(=O)N=C3)C4=C(C=CC=C4F)F)C(C)(C)C

DOS

IR

Vibrations