Geometry & MOs

Info

ID:	216122
PubChem CID:	85085759
Reduced:	O2C6H11 (2)
Stoich.:	A2B6C11 (2)
Weight, g/mol:	230.13068
ΔH_f, kcal/mol:	-223.55
Dipole, Da:	1.39
IP(EA), eV:	-10.75(0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-benzylidene-5-methylcyclopentane-1-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C(C)C(C(C)(C)C)OC(=O)C

DOS

IR

Vibrations