Geometry & MOs

Info

ID:	199923
PubChem CID:	79317701
Reduced:	O4N5C11H13 (1)
Stoich.:	A4B5C11D13 (1)
Weight, g/mol:	241.117489
ΔH_f, kcal/mol:	-51.91
Dipole, Da:	7.04
IP(EA), eV:	-9.81(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 1-[1-(dimethylamino)-1-oxopropan-2-yl]tetrazole-5-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=NN=NN1CC(=O)NCC2=CC=CO2

DOS

IR

Vibrations