Geometry & MOs

Info

ID:	255871
PubChem CID:	103135317
Reduced:	N3C17H31 (1)
Stoich.:	A3B17C31 (1)
Weight, g/mol:	284.117922
ΔH_f, kcal/mol:	-3.38
Dipole, Da:	1.94
IP(EA), eV:	-8.54(0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[4-(chloromethyl)-2-ethoxyphenoxy]methyl]-5-methyloxolane

Drug info:

PubChemData

Smile

CCCCC1CCC(CC1)C(C2=NN(C=C2)C)NCC

DOS

IR

Vibrations