Geometry & MOs

Info

ID:	318836
PubChem CID:	126653524
Reduced:	F2N3H17C20 (1)
Stoich.:	A2B3C17D20 (1)
Weight, g/mol:	276.147393
ΔH_f, kcal/mol:	7.47
Dipole, Da:	3.51
IP(EA), eV:	-8.36(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-(2-oxo-2-pyridin-2-ylethyl)azetidine-1-carboxylate

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC2=CC=C(C=C2)N=NC3=CC(=C(C=C3)C)F)F

DOS

IR

Vibrations