Geometry & MOs

Info

ID:	441515
PubChem CID:	135235650
Reduced:	O3C29H56 (1)
Stoich.:	A3B29C56 (1)
Weight, g/mol:	384.159769
ΔH_f, kcal/mol:	-260.02
Dipole, Da:	4.88
IP(EA), eV:	-10.61(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[3-(4-fluoro-2-methoxyphenyl)pyridin-2-yl]oxy-N-(2-methoxyethyl)-N-methylpyrimidin-2-amine

Drug info:

PubChemData

Smile

CCCCCCCCCCCCC(CCCCCCCCCC)C(=O)OC(=O)CCCC

DOS

IR

Vibrations