Geometry & MOs

Info

ID:	390399
PubChem CID:	134998974
Reduced:	NO2C17H19 (1)
Stoich.:	AB2C17D19 (1)
Weight, g/mol:	292.167459
ΔH_f, kcal/mol:	3.24
Dipole, Da:	2.07
IP(EA), eV:	-8.24(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(6-benzyl-2-methoxyoxan-2-yl)acetate

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)/C=[N+](/CCCC2=CC=CC=C2)\[O-]

DOS

IR

Vibrations