Geometry & MOs

Info

ID:

229775

PubChem CID:

87568935

Reduced:

OVC4H10 (1)

Stoich.:

ABC4D10 (1)

Weight, g/mol:

398.33961

ΔHf, kcal/mol:

15.0

Dipole, Da:

2.4

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 2.426044

Charge, e:

 0

Chem-info

IUPAC name:

2,2-bis(2-ethylbutyl)-10-methylundecanedioic acid

Drug info:

PubChemData

Smile

CCCCO.[V]

DOS

IR

Vibrations