Geometry & MOs

Info

ID:	48440
PubChem CID:	10584659
Reduced:	O3C12H20 (1)
Stoich.:	A3B12C20 (1)
Weight, g/mol:	212.141244
ΔH_f, kcal/mol:	-152.17
Dipole, Da:	2.95
IP(EA), eV:	-9.81(0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-cyclohexyl-4-hydroxy-2-methylidenebutanoate

Drug info:

PubChemData

Smile

CCOC(=O)CC(/C=C/C(C)C)C(=O)C

DOS

IR

Vibrations