Geometry & MOs

Info

ID:

433825

PubChem CID:

135173968

Reduced:

NOC13H29 (1)

Stoich.:

ABC13D29 (1)

Weight, g/mol:

211.23

ΔHf, kcal/mol:

-93.72

Dipole, Da:

2.84

IP(EA), eV:

-8.93(2.22)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-(3,3-dimethylbutyl)-4-propan-2-ylpiperidine

Drug info:

PubChemData

Smile

CC(C(C)(C)CC(C)(C)C)OCCNC

DOS

IR

Vibrations