Geometry & MOs

Info

ID:	19541
PubChem CID:	567100
Reduced:	O4C13H22 (1)
Stoich.:	A4B13C22 (1)
Weight, g/mol:	242.151809
ΔH_f, kcal/mol:	-186.64
Dipole, Da:	1.7
IP(EA), eV:	-10.23(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

butyl 6-propoxy-3,6-dihydro-2H-pyran-2-carboxylate

Drug info:

PubChemData

Smile

CCCCOC(=O)C1CC=CC(O1)OCCC

DOS

IR

Vibrations