Geometry & MOs

Info

ID:	271155
PubChem CID:	103645650
Reduced:	FN2O4C15H19 (1)
Stoich.:	AB2C4D15E19 (1)
Weight, g/mol:	322.189257
ΔH_f, kcal/mol:	-197.58
Dipole, Da:	4.77
IP(EA), eV:	-9.22(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-(3-ethoxy-4-methoxyanilino)azetidine-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CC(C1)NC2=C(C=CC(=C2)C(=O)O)F

DOS

IR

Vibrations