Geometry & MOs

Info

ID:	337057
PubChem CID:	127256622
Reduced:	N2O3C17H24 (1)
Stoich.:	A2B3C17D24 (1)
Weight, g/mol:	168.078644
ΔH_f, kcal/mol:	-103.85
Dipole, Da:	4.89
IP(EA), eV:	-7.97(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC1=CC=CC=C1N/N=C\2/CCCOC2(CC)CC(=O)O

DOS

IR

Vibrations