Geometry & MOs

Info

ID:	201585
PubChem CID:	79559462
Reduced:	NC9H16 (2)
Stoich.:	AB9C16 (2)
Weight, g/mol:	261.220498
ΔH_f, kcal/mol:	-3.74
Dipole, Da:	1.19
IP(EA), eV:	-8.0(2.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(azepan-2-yl)-N-[(6-methylpyridin-3-yl)methyl]propan-2-amine

Drug info:

PubChemData

Smile

CCC1(CNC(CN1CC2CC3CCC2C3)C4CC4)C

DOS

IR

Vibrations