Geometry & MOs

Info

ID:	58343
PubChem CID:	24697892
Reduced:	NOC9H11 (2)
Stoich.:	ABC9D11 (2)
Weight, g/mol:	247.204848
ΔH_f, kcal/mol:	-58.85
Dipole, Da:	6.48
IP(EA), eV:	-8.34(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(aminomethyl)-N-benzyl-N,1-dimethylpiperidin-4-amine

Drug info:

PubChemData

Smile

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2C)N

DOS

IR

Vibrations