Geometry & MOs

Info

ID:

221426

PubChem CID:

85272973

Reduced:

ClON2C14H23 (1)

Stoich.:

ABC2D14E23 (1)

Weight, g/mol:

270.06193

ΔHf, kcal/mol:

-36.43

Dipole, Da:

5.95

IP(EA), eV:

-9.34(-0.18)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-bromo-7-methoxytetracyclo[6.2.1.13,6.02,7]dodecane

Drug info:

PubChemData

Smile

CC[NH+](CC)CCON=C(C)C1=CC=CC=C1.[Cl-]

DOS

IR

Vibrations