Geometry & MOs

Info

ID:

303063

PubChem CID:

124489165

Reduced:

ClNC10H20 (1)

Stoich.:

ABC10D20 (1)

Weight, g/mol:

175.112777

ΔHf, kcal/mol:

-44.22

Dipole, Da:

1.23

IP(EA), eV:

-8.66(0.88)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(3S)-3-(chloromethyl)-1-propylpiperidine

Drug info:

PubChemData

Smile

CC(C)CN1CCC[C@H](C1)CCl

DOS

IR

Vibrations