Geometry & MOs

Info

ID:

295794

PubChem CID:

117544089

Reduced:

ON2C13H18 (1)

Stoich.:

AB2C13D18 (1)

Weight, g/mol:

183.162314

ΔHf, kcal/mol:

-18.59

Dipole, Da:

2.12

IP(EA), eV:

-8.97(-0.16)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-butyl-2,2-dimethylpiperidin-3-one

Drug info:

PubChemData

Smile

CC1(C(=O)CCCN1CC2=CC=NC=C2)C

DOS

IR

Vibrations