Geometry & MOs

Info

ID:	2873
PubChem CID:	8767
Reduced:	OC9H13 (2)
Stoich.:	AB9C13 (2)
Weight, g/mol:	274.19328
ΔH_f, kcal/mol:	-97.9
Dipole, Da:	2.18
IP(EA), eV:	-9.19(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,7-dimethyloct-6-enyl 2-phenylacetate

Drug info:

PubChemData

Smile

CC(CCC=C(C)C)CCOC(=O)CC1=CC=CC=C1

DOS

IR

Vibrations