Geometry & MOs

Info

ID:	251569
PubChem CID:	103104961
Reduced:	NOC4H7 (3)
Stoich.:	ABC4D7 (3)
Weight, g/mol:	270.132805
ΔH_f, kcal/mol:	-115.44
Dipole, Da:	4.05
IP(EA), eV:	-10.25(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 1-[2-(2-methoxyethylamino)-2-oxoethyl]-5-methyltriazole-4-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(N(N=N1)CC(C)(C(C)C)O)C

DOS

IR

Vibrations