Geometry & MOs

Info

ID:	388457
PubChem CID:	134989210
Reduced:	NO2C11H19 (1)
Stoich.:	AB2C11D19 (1)
Weight, g/mol:	168.11503
ΔH_f, kcal/mol:	-98.48
Dipole, Da:	4.36
IP(EA), eV:	-10.74(0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-ethenyl-5-methylhex-4-enoate

Drug info:

PubChemData

Smile

CC(CC(C)(C)C(C)C#N)C(=O)OC

DOS

IR

Vibrations