Geometry & MOs

Info

ID:	177111
PubChem CID:	76136184
Reduced:	NO6C15H31 (1)
Stoich.:	AB6C15D31 (1)
Weight, g/mol:	456.052189
ΔH_f, kcal/mol:	-317.12
Dipole, Da:	2.42
IP(EA), eV:	-9.37(1.12)
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]-3-(carbamoyloxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Drug info:

PubChemData

Smile

CCCCCCCCCN1C(C(C(C(C1(CO)O)O)O)O)O

DOS

IR

Vibrations