Geometry & MOs

Info

ID:	248981
PubChem CID:	103086030
Reduced:	FO2N6C12H15 (1)
Stoich.:	AB2C6D12E15 (1)
Weight, g/mol:	261.15896
ΔH_f, kcal/mol:	44.11
Dipole, Da:	3.37
IP(EA), eV:	-9.75(-2.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-1-[1-[2-(methoxymethyl)phenyl]tetrazol-5-yl]ethanamine

Drug info:

PubChemData

Smile

CCCNC(C)C1=NN=NN1C2=C(C=C(C=C2)[N+](=O)[O-])F

DOS

IR

Vibrations