Geometry & MOs

Info

ID:	325209
PubChem CID:	126681966
Reduced:	ON2C4H7 (2)
Stoich.:	AB2C4D7 (2)
Weight, g/mol:	252.158626
ΔH_f, kcal/mol:	-33.29
Dipole, Da:	2.19
IP(EA), eV:	-10.47(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[1-(cyclohexylmethyl)tetrazol-5-yl]acetate

Drug info:

PubChemData

Smile

CCCN1N=C(N=N1)CC(=O)OCC

DOS

IR

Vibrations