Geometry & MOs

Info

ID:	229655
PubChem CID:	87568332
Reduced:	NOC13H30 (2)
Stoich.:	ABC13D30 (2)
Weight, g/mol:	202.048147
ΔH_f, kcal/mol:	-210.47
Dipole, Da:	6.43
IP(EA), eV:	-9.55(2.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCCCC(C)(CCCC)C(CCCCCO)(C(C)(CCCC)CCCC)O.N.N

DOS

IR

Vibrations