Geometry & MOs

Info

ID:

17440

PubChem CID:

498754

Reduced:

C14H19 (1)

Stoich.:

A14B19 (1)

Weight, g/mol:

187.148676

ΔHf, kcal/mol:

6.97

Dipole, Da:

0.58

IP(EA), eV:

0.0(0.0)

Spin(Sz, S2):

0.500000, 0.879523

Charge, e:

0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1CC[C]2[CH][C]3CCCC[C]3[C]2CC1

DOS

IR

Vibrations