Geometry & MOs

Info

ID:	251834
PubChem CID:	103107247
Reduced:	N2O2C13H28 (1)
Stoich.:	A2B2C13D28 (1)
Weight, g/mol:	276.133474
ΔH_f, kcal/mol:	-129.69
Dipole, Da:	4.21
IP(EA), eV:	-8.85(1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 5-cyclopropyl-1-[(4-methyl-1,2,4-triazol-3-yl)methyl]triazole-4-carboxylate

Drug info:

PubChemData

Smile

CCN(C)C(=O)C(C)NC(C)CC(C)(C)OC

DOS

IR

Vibrations