Geometry & MOs

Info

ID:	17401
PubChem CID:	495981
Reduced:	O9C24H28 (1)
Stoich.:	A9B24C28 (1)
Weight, g/mol:	460.173332
ΔH_f, kcal/mol:	-338.18
Dipole, Da:	5.61
IP(EA), eV:	-9.95(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC1CC(=O)C2(C(C13CC(OC3=O)C4=COC=C4)CCC(C25CO5)OC(=O)C)COC(=O)C

DOS

IR

Vibrations