Geometry & MOs

Info

ID:	148858
PubChem CID:	53788527
Reduced:	ON5C22H29 (1)
Stoich.:	AB5C22D29 (1)
Weight, g/mol:	266.996821
ΔH_f, kcal/mol:	57.21
Dipole, Da:	3.97
IP(EA), eV:	-8.91(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5S)-2-(1-chloro-2-oxopropoxy)-4,4-dioxo-4lambda6-thia-1-azabicyclo[3.2.0]heptan-7-one

Drug info:

PubChemData

Smile

CCCN(CCC)C(=NN(CC1=CC=CC=C1)C(=N)N)C2=CC=C(C=C2)C=O

DOS

IR

Vibrations