Geometry & MOs

Info

ID:

207414

PubChem CID:

80394096

Reduced:

NO2C13H29 (1)

Stoich.:

AB2C13D29 (1)

Weight, g/mol:

221.177964

ΔHf, kcal/mol:

-127.88

Dipole, Da:

1.62

IP(EA), eV:

-8.96(2.04)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

N-[3-(3-methylbutan-2-yloxy)propyl]aniline

Drug info:

PubChemData

Smile

CCCCOCCNCCOC(C)C(C)C

DOS

IR

Vibrations