Geometry & MOs

Info

ID:

220445

PubChem CID:

85195382

Reduced:

NOC14H17 (1)

Stoich.:

ABC14D17 (1)

Weight, g/mol:

215.1674

ΔHf, kcal/mol:

-26.38

Dipole, Da:

3.7

IP(EA), eV:

-9.54(0.14)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-benzyl-4-ethenyl-3-methylpiperidine

Drug info:

PubChemData

Smile

C1CC2CC1C(C2C(=O)N)C3=CC=CC=C3

DOS

IR

Vibrations