Geometry & MOs

Info

ID:	252516
PubChem CID:	103111918
Reduced:	N3O4C14H23 (1)
Stoich.:	A3B4C14D23 (1)
Weight, g/mol:	293.148789
ΔH_f, kcal/mol:	-138.08
Dipole, Da:	5.27
IP(EA), eV:	-9.89(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxyethyl 1-[(2,5-dimethylpyrazol-3-yl)methyl]-5-methyltriazole-4-carboxylate

Drug info:

PubChemData

Smile

CC1=C(N=NN1C2CCCC(C2)OC)C(=O)OCCOC

DOS

IR

Vibrations