Geometry & MOs

Info

ID:	276980
PubChem CID:	103826126
Reduced:	O2N4C11H18 (1)
Stoich.:	A2B4C11D18 (1)
Weight, g/mol:	225.12774
ΔH_f, kcal/mol:	-37.25
Dipole, Da:	6.04
IP(EA), eV:	-9.31(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(5-fluoropyrimidin-2-yl)piperidin-4-yl]ethanol

Drug info:

PubChemData

Smile

CCC1(CCNC1)C(=O)NCC2=NOC(=N2)C

DOS

IR

Vibrations