Geometry & MOs

Info

ID:	283266
PubChem CID:	103969178
Reduced:	ClN3C13H22 (1)
Stoich.:	AB3C13D22 (1)
Weight, g/mol:	252.139326
ΔH_f, kcal/mol:	5.11
Dipole, Da:	3.51
IP(EA), eV:	-8.94(0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(chloromethyl)cyclohexyl]methyl]-1-pyridin-3-ylmethanamine

Drug info:

PubChemData

Smile

CN1C=C(C=N1)CNCC2(CCCCC2)CCl

DOS

IR

Vibrations