Geometry & MOs

Info

ID:	381209
PubChem CID:	134971870
Reduced:	O6C21H26 (1)
Stoich.:	A6B21C26 (1)
Weight, g/mol:	340.039795
ΔH_f, kcal/mol:	-252.02
Dipole, Da:	5.81
IP(EA), eV:	-10.15(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C[C@@H]1C2[C@H](C(CC2[C@@H](C13OCCO3)C(=O)O)(C)C)OC(=O)C4=CC=CC=C4

DOS

IR

Vibrations