Geometry & MOs

Info

ID:	422127
PubChem CID:	135117257
Reduced:	ClNO2C17H24 (1)
Stoich.:	ABC2D17E24 (1)
Weight, g/mol:	367.237211
ΔH_f, kcal/mol:	-104.72
Dipole, Da:	4.78
IP(EA), eV:	-8.87(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,5-dimethyl-6-[4-(pyridin-2-ylmethoxy)piperidin-1-yl]-2-pyrrolidin-1-ylpyrimidine

Drug info:

PubChemData

Smile

CC1(CCOC2(C1)CCN(CC2)CC3=CC(=CC=C3)Cl)O

DOS

IR

Vibrations