Geometry & MOs

Info

ID:	27536
PubChem CID:	821867
Reduced:	ON5H13C14 (1)
Stoich.:	AB5C13D14 (1)
Weight, g/mol:	283.106925
ΔH_f, kcal/mol:	70.79
Dipole, Da:	4.8
IP(EA), eV:	-9.14(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C)NC(=O)C2=NN3C=CC=NC3=N2

DOS

IR

Vibrations