Geometry & MOs

Info

ID:	285314
PubChem CID:	104099017
Reduced:	ON4C10H18 (1)
Stoich.:	AB4C10D18 (1)
Weight, g/mol:	234.159295
ΔH_f, kcal/mol:	4.72
Dipole, Da:	4.37
IP(EA), eV:	-9.6(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(triazol-1-yl)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]ethanamine

Drug info:

PubChemData

Smile

C1CC(COC1)CNCCN2C=CN=N2

DOS

IR

Vibrations