Geometry & MOs

Info

ID:

229686

PubChem CID:

87568457

Reduced:

NSiC6H14 (1)

Stoich.:

ABC6D14 (1)

Weight, g/mol:

146.076536

ΔHf, kcal/mol:

32.23

Dipole, Da:

2.37

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.752751

Charge, e:

 0

Chem-info

IUPAC name:

O-(3,3-dimethylbutyl) methanethioate

Drug info:

PubChemData

Smile

CCN(C(C)(C)C)[Si]

DOS

IR

Vibrations