Geometry & MOs

Info

ID:	189590
PubChem CID:	77876979
Reduced:	O5C23H36 (1)
Stoich.:	A5B23C36 (1)
Weight, g/mol:	272.028935
ΔH_f, kcal/mol:	-267.67
Dipole, Da:	3.62
IP(EA), eV:	-8.71(0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-aminocyclobutyl)sulfanyl-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

Drug info:

PubChemData

Smile

CC(=O)OC12CCCC1C(C(C2)OC3CCCCO3)C(=CCC4CCCC4)O

DOS

IR

Vibrations