Geometry & MOs

Info

ID:	396403
PubChem CID:	135028287
Reduced:	O4C15H22 (1)
Stoich.:	A4B15C22 (1)
Weight, g/mol:	416.238286
ΔH_f, kcal/mol:	-162.31
Dipole, Da:	0.69
IP(EA), eV:	-9.95(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C[C@H]1[C@H](C2([C@H]3[C@@]1(C(=O)C(=C[C@]3(CO2)CO)C)C)C)O

DOS

IR

Vibrations