Geometry & MOs

Info

ID:	196270
PubChem CID:	78804377
Reduced:	NO4C16H21 (1)
Stoich.:	AB4C16D21 (1)
Weight, g/mol:	294.146724
ΔH_f, kcal/mol:	-169.88
Dipole, Da:	3.85
IP(EA), eV:	-9.86(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

oxan-2-ylmethyl 2-(2,5-dimethoxyphenyl)acetate

Drug info:

PubChemData

Smile

CC(=O)NCC1=CC=C(C=C1)C(=O)OCC2CCCCO2

DOS

IR

Vibrations