Geometry & MOs

Info

ID:	251757
PubChem CID:	103106695
Reduced:	FO2N3C14H22 (1)
Stoich.:	AB2C3D14E22 (1)
Weight, g/mol:	277.117489
ΔH_f, kcal/mol:	-121.53
Dipole, Da:	6.32
IP(EA), eV:	-7.88(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCN(C)C(=O)C(C)NC1=CC(=C(C=C1N)F)OCC

DOS

IR

Vibrations