Geometry & MOs

Info

ID:	207315
PubChem CID:	80374974
Reduced:	F2N2O3H10C14 (1)
Stoich.:	A2B2C3D10E14 (1)
Weight, g/mol:	224.163711
ΔH_f, kcal/mol:	-165.46
Dipole, Da:	7.24
IP(EA), eV:	-9.89(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-ethyl-N,N-dipropyl-1H-1,2,4-triazole-3-carboxamide

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)F)CC(=O)NC2=NC=C(C=C2)C(=O)O)F

DOS

IR

Vibrations