Geometry & MOs

Info

ID:	415552
PubChem CID:	135088548
Reduced:	NOC7H9 (3)
Stoich.:	ABC7D9 (3)
Weight, g/mol:	337.140197
ΔH_f, kcal/mol:	-86.1
Dipole, Da:	4.39
IP(EA), eV:	-8.62(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(pyridin-2-ylmethoxy)piperidin-1-yl]-6-(trifluoromethyl)pyridine

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CCNC(=O)CN2C[C@H]([C@@H](C2)O)CC3=CC=CC=N3

DOS

IR

Vibrations