Geometry & MOs

Info

ID:	199930
PubChem CID:	79318247
Reduced:	O4N7C9H11 (1)
Stoich.:	A4B7C9D11 (1)
Weight, g/mol:	340.0171
ΔH_f, kcal/mol:	-26.9
Dipole, Da:	6.65
IP(EA), eV:	-9.96(-1.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 1-[2-(4-bromophenoxy)ethyl]tetrazole-5-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=NN=NN1CC(=O)NC2=NN=C(O2)C

DOS

IR

Vibrations