Geometry & MOs

Info

ID:	426940
PubChem CID:	135154663
Reduced:	ClOSN2H9C11 (1)
Stoich.:	ABCD2E9F11 (1)
Weight, g/mol:	664.300078
ΔH_f, kcal/mol:	4.02
Dipole, Da:	2.74
IP(EA), eV:	-9.02(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-4-[4-(6-methoxypyridin-3-yl)oxypiperidin-1-yl]-5-methylpyrimidine;[4-[4-(6-methoxypyridin-3-yl)oxypiperidin-1-yl]-5-methylpyrimidin-2-yl]hydrazine

Drug info:

PubChemData

Smile

CC1=CN=C(S1)C(=O)NC2=CC=CC=C2Cl

DOS

IR

Vibrations