Geometry & MOs

Info

ID:	220245
PubChem CID:	85177003
Reduced:	N2O3H10C12 (1)
Stoich.:	A2B3C10D12 (1)
Weight, g/mol:	230.167065
ΔH_f, kcal/mol:	-35.69
Dipole, Da:	4.51
IP(EA), eV:	-10.24(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-ethyl-1-methylcyclopent-2-en-1-yl)methoxymethylbenzene

Drug info:

PubChemData

Smile

COC(=O)C1C(OC=N1)(C#N)C2=CC=CC=C2

DOS

IR

Vibrations