Geometry & MOs

Info

ID:

134219

PubChem CID:

51663641

Reduced:

N2C6H15 (1)

Stoich.:

A2B6C15 (1)

Weight, g/mol:

256.170139

ΔHf, kcal/mol:

9.26

Dipole, Da:

3.05

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.754948

Charge, e:

 1

Chem-info

IUPAC name:

ethyl-[[2-[(3-methylphenyl)methoxy]phenyl]methyl]azanium

Drug info:

PubChemData

Smile

CCN1CC[C@H](C1)[NH3+]

DOS

IR

Vibrations