Geometry & MOs

Info

ID:	362
PubChem CID:	2655
Reduced:	S2N5O5C13H13 (1)
Stoich.:	A2B5C5D13E13 (1)
Weight, g/mol:	383.035811
ΔH_f, kcal/mol:	-72.42
Dipole, Da:	6.86
IP(EA), eV:	-9.11(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[[2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Drug info:

PubChemData

Smile

CON=C(C1=CSC(=N1)N)C(=O)NC2C3N(C2=O)C(=CCS3)C(=O)O

DOS

IR

Vibrations