Geometry & MOs

Info

ID:	251863
PubChem CID:	103107443
Reduced:	ON4C10H18 (1)
Stoich.:	AB4C10D18 (1)
Weight, g/mol:	198.111676
ΔH_f, kcal/mol:	-24.71
Dipole, Da:	8.2
IP(EA), eV:	-9.11(0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCN(C)C(=O)C(C)NCC1=CN=CN1

DOS

IR

Vibrations