Geometry & MOs

Info

ID:	439610
PubChem CID:	135229396
Reduced:	FNC17H34 (1)
Stoich.:	ABC17D34 (1)
Weight, g/mol:	703.305307
ΔH_f, kcal/mol:	-118.68
Dipole, Da:	2.95
IP(EA), eV:	-9.06(2.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methylsulfanyl-1-[2-oxo-2-[1-(5-pyrimidin-2-ylpyridin-2-yl)piperidin-4-yl]ethyl]-N-[3-(6-propan-2-yloxypyridin-3-yl)-1H-indazol-5-yl]-3,6-dihydro-2H-pyridine-5-carboxamide

Drug info:

PubChemData

Smile

CCCCCCC(CCCCC)C1(CCNCC1)F

DOS

IR

Vibrations