Geometry & MOs

Info

ID:	337058
PubChem CID:	127256623
Reduced:	OC3H4 (3)
Stoich.:	AB3C4 (3)
Weight, g/mol:	336.266445
ΔH_f, kcal/mol:	-114.42
Dipole, Da:	2.14
IP(EA), eV:	-8.92(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-pentylnonyl 2-(2H-pyran-2-yl)acetate

Drug info:

PubChemData

Smile

CCOC(=O)CC1C=CC=CO1

DOS

IR

Vibrations