Geometry & MOs

Info

ID:	27530
PubChem CID:	821856
Reduced:	O2N5C17H19 (1)
Stoich.:	A2B5C17D19 (1)
Weight, g/mol:	283.106925
ΔH_f, kcal/mol:	23.68
Dipole, Da:	4.64
IP(EA), eV:	-8.38(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-ethoxyphenyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)C2=NN3C=CC=NC3=N2

DOS

IR

Vibrations