Geometry & MOs

Info

ID:

20000

PubChem CID:

576499

Reduced:

N2C19H25 (1)

Stoich.:

A2B19C25 (1)

Weight, g/mol:

281.201774

ΔHf, kcal/mol:

67.43

Dipole, Da:

2.67

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 1.116302

Charge, e:

 1

Chem-info

IUPAC name:

1,1,4-trimethyl-2,3-diphenylpiperazin-1-ium

Drug info:

PubChemData

Smile

CN1CC[N+](C(C1C2=CC=CC=C2)C3=CC=CC=C3)(C)C

DOS

IR

Vibrations