Geometry & MOs

Info

ID:	158868
PubChem CID:	57244117
Reduced:	SiO2C16H30 (2)
Stoich.:	AB2C16D30 (2)
Weight, g/mol:	334.240899
ΔH_f, kcal/mol:	-348.69
Dipole, Da:	2.32
IP(EA), eV:	-8.73(0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-benzyl-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidin-4-amine

Drug info:

PubChemData

Smile

CCCCC(C)(CC=C[C@@H]1[C@@H](C[C@H]2[C@@H]1CC(=C)C2OC(=O)C)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C

DOS

IR

Vibrations