Geometry & MOs

Info

ID:	188665
PubChem CID:	77751392
Reduced:	N3O4C20H33 (1)
Stoich.:	A3B4C20D33 (1)
Weight, g/mol:	608.009089
ΔH_f, kcal/mol:	-204.61
Dipole, Da:	3.28
IP(EA), eV:	-9.75(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[5-chloro-2-(2,4-dichlorophenoxy)phenoxy]methyl]-7-[[2-(1H-imidazol-5-yl)acetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NCCCCC(C(=O)NC(CC1=CC=CC=C1)CO)N

DOS

IR

Vibrations