Geometry & MOs

Info

ID:	222603
PubChem CID:	85305602
Reduced:	O2C12H13 (2)
Stoich.:	A2B12C13 (2)
Weight, g/mol:	380.74927
ΔH_f, kcal/mol:	-110.46
Dipole, Da:	2.35
IP(EA), eV:	-9.53(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC1(OC(C(O1)C(CC=C)OC(=O)C=CC2=CC=CC=C2)C3=CC=CC=C3)C

DOS

IR

Vibrations