Geometry & MOs

Info

ID:	220253
PubChem CID:	85177079
Reduced:	O2C15H22 (1)
Stoich.:	A2B15C22 (1)
Weight, g/mol:	234.16198
ΔH_f, kcal/mol:	-82.24
Dipole, Da:	2.9
IP(EA), eV:	-9.18(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-hydroxy-1,1,4,7-tetramethyl-2,5,6,7,7a,7b-hexahydro-1aH-cyclopropa[e]azulen-3-one

Drug info:

PubChemData

Smile

CCCCC#CC=C1CCCCC1OC(=O)C

DOS

IR

Vibrations