Geometry & MOs

Info

ID:	284020
PubChem CID:	104026883
Reduced:	OF2N2C10H10 (1)
Stoich.:	AB2C2D10E10 (1)
Weight, g/mol:	221.080041
ΔH_f, kcal/mol:	-92.11
Dipole, Da:	3.56
IP(EA), eV:	-9.8(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-1-[(3-nitrophenyl)methyl]azetidin-2-one

Drug info:

PubChemData

Smile

C1C(C(=O)N1CC2=C(C=C(C=C2)F)F)N

DOS

IR

Vibrations