Geometry & MOs

Info

ID:	48602
PubChem CID:	11109886
Reduced:	O3C20H28 (1)
Stoich.:	A3B20C28 (1)
Weight, g/mol:	316.091305
ΔH_f, kcal/mol:	-123.39
Dipole, Da:	3.97
IP(EA), eV:	-8.99(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

trimethylsilyl (6R,7R)-7-amino-3-(methoxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Drug info:

PubChemData

Smile

CC1=C(C(C[C@H](C1)O)(C)C)/C=C/C(=C/C=C/C(=C\C(=O)O)/C)/C

DOS

IR

Vibrations