Geometry & MOs

Info

ID:	224000
PubChem CID:	85336769
Reduced:	FO3N4C24H33 (1)
Stoich.:	AB3C4D24E33 (1)
Weight, g/mol:	439.062026
ΔH_f, kcal/mol:	-141.27
Dipole, Da:	5.26
IP(EA), eV:	-9.16(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[[2-(2-amino-1,3-thiazol-4-yl)-2-(carboxymethoxyimino)acetyl]amino]-3-ethenyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Drug info:

PubChemData

Smile

COC1C2C(CC(C1N3CCC(C3)(CC4=CC=CC=C4)CN)F)C(=O)NC(=O)N2C5CC5

DOS

IR

Vibrations