Geometry & MOs

Info

ID:	404224
PubChem CID:	135065497
Reduced:	O4C17H24 (1)
Stoich.:	A4B17C24 (1)
Weight, g/mol:	262.139137
ΔH_f, kcal/mol:	-158.13
Dipole, Da:	8.53
IP(EA), eV:	-9.6(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC(C)(C)C1CCC(=CC1)C#CC(C)(C2COC(=O)O2)O

DOS

IR

Vibrations