Geometry & MOs

Info

ID:	222563
PubChem CID:	85305529
Reduced:	O4C23H30 (1)
Stoich.:	A4B23C30 (1)
Weight, g/mol:	370.214409
ΔH_f, kcal/mol:	-160.76
Dipole, Da:	3.7
IP(EA), eV:	-8.32(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

10-(4-ethenylphenyl)-1,5,9-trimethyl-11,14,15,16-tetraoxatetracyclo[10.3.1.04,13.08,13]hexadecane

Drug info:

PubChemData

Smile

CC(=O)OCC(=O)C1=CCC2C1(CCC3C2CC=C4C3CCC(=C4)OC)C

DOS

IR

Vibrations