Geometry & MOs

Info

ID:	19338
PubChem CID:	561968
Reduced:	OC7H10 (2)
Stoich.:	AB7C10 (2)
Weight, g/mol:	220.14633
ΔH_f, kcal/mol:	-99.0
Dipole, Da:	1.66
IP(EA), eV:	-9.35(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-methyl-5-phenylpentanoate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations