Geometry & MOs

Info

ID:

410174

PubChem CID:

135082965

Reduced:

NC11H14 (1)

Stoich.:

AB11C14 (1)

Weight, g/mol:

172.065432

ΔHf, kcal/mol:

46.21

Dipole, Da:

0.96

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.979639

Charge, e:

 0

Chem-info

IUPAC name:

potassium;tert-butylbenzene

Drug info:

PubChemData

Smile

CC(=C)[CH]N(C)C1=CC=CC=C1

DOS

IR

Vibrations