Geometry & MOs

Info

ID:	341304
PubChem CID:	127263997
Reduced:	NO2C8H11 (2)
Stoich.:	AB2C8D11 (2)
Weight, g/mol:	281.189198
ΔH_f, kcal/mol:	-149.48
Dipole, Da:	4.1
IP(EA), eV:	-8.8(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-benzyl-4-pyridin-4-ylpiperidin-4-yl)methanamine

Drug info:

PubChemData

Smile

C1CN(CCC12CNC2)CC3=CC=CC=C3.C(=O)(C(=O)O)O

DOS

IR

Vibrations