Geometry & MOs

Info

ID:	81864
PubChem CID:	49855270
Reduced:	ClSF2O2N3H18C27 (1)
Stoich.:	ABC2D2E3F18G27 (1)
Weight, g/mol:	351.077454
ΔH_f, kcal/mol:	-64.24
Dipole, Da:	5.83
IP(EA), eV:	-8.98(-1.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-4-(furan-2-yl)-1-(4-phenyldiazenylphenyl)azetidin-2-one

Drug info:

PubChemData

Smile

CC1=C(C(N2C(=O)/C(=C\C3=CC=C(C=C3)Cl)/SC2=N1)C4=CC=C(C=C4)F)C(=O)NC5=CC=C(C=C5)F

DOS

IR

Vibrations