Geometry & MOs

Info

ID:	399700
PubChem CID:	135041885
Reduced:	OC16H16 (1)
Stoich.:	AB16C16 (1)
Weight, g/mol:	204.091708
ΔH_f, kcal/mol:	78.7
Dipole, Da:	2.84
IP(EA), eV:	-9.52(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 5-chloro-2-ethenyl-2-methylpentanoate

Drug info:

PubChemData

Smile

C/C=C/[C@H](C#CC#CCCC1=CC=CC=C1)O

DOS

IR

Vibrations