Geometry & MOs

Info

ID:	251870
PubChem CID:	103107490
Reduced:	ON3C12H25 (1)
Stoich.:	AB3C12D25 (1)
Weight, g/mol:	235.106925
ΔH_f, kcal/mol:	-70.58
Dipole, Da:	4.73
IP(EA), eV:	-8.76(0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 1-[2-(1-methylimidazol-2-yl)ethyl]triazole-4-carboxylate

Drug info:

PubChemData

Smile

CCN(C)C(=O)C(C)NCC1CCCNC1

DOS

IR

Vibrations