Geometry & MOs

Info

ID:	427371
PubChem CID:	135157812
Reduced:	O6C23H26 (1)
Stoich.:	A6B23C26 (1)
Weight, g/mol:	286.19328
ΔH_f, kcal/mol:	-218.06
Dipole, Da:	1.44
IP(EA), eV:	-8.7(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

spiro[5,7,8,9-tetrahydrobenzo[7]annulene-6,1'-cyclobutane]-5-yl 2,2-dimethylpropanoate

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)OC(=O)C(=C)C)OCC2=CC(=CC(=C2)OC(=O)C(C)(C)C)O

DOS

IR

Vibrations