Geometry & MOs

Info

ID:	249135
PubChem CID:	103087090
Reduced:	ON5C13H27 (1)
Stoich.:	AB5C13D27 (1)
Weight, g/mol:	235.154544
ΔH_f, kcal/mol:	-15.13
Dipole, Da:	6.37
IP(EA), eV:	-9.45(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(1,3-dimethylpyrazol-4-yl)tetrazol-5-yl]-N-ethylethanamine

Drug info:

PubChemData

Smile

CCOC(C)(C)CN1C(=NN=N1)C(C)NCC(C)C

DOS

IR

Vibrations