Geometry & MOs

Info

ID:

149957

PubChem CID:

53789640

Reduced:

NOC5H7 (2)

Stoich.:

ABC5D7 (2)

Weight, g/mol:

660.483923

ΔHf, kcal/mol:

-72.62

Dipole, Da:

6.63

IP(EA), eV:

-9.78(0.17)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-(1,4-dimethylpiperidin-4-yl)pyridine;N-[(1-methyl-4-pyridin-3-ylpiperidin-4-yl)methoxy]methanamine;N-[(1-methyl-4-pyridin-4-ylpiperidin-4-yl)methoxy]methanamine

Drug info:

PubChemData

Smile

C1CC2C(C=C1)NCC(C2=O)C(=O)N

DOS

IR

Vibrations