Geometry & MOs

Info

ID:

366

PubChem CID:

2660

Reduced:

SN4O10C20H22 (1)

Stoich.:

AB4C10D20E22 (1)

Weight, g/mol:

510.105664

ΔHf, kcal/mol:

-309.75

Dipole, Da:

3.81

IP(EA), eV:

 -9.35(-1.01)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-acetyloxyethyl 3-(carbamoyloxymethyl)-7-[[2-(furan-3-yl)-2-methoxyiminoacetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Drug info:

PubChemData

Smile

CC(OC(=O)C)OC(=O)C1=C(CSC2N1C(=O)C2NC(=O)C(=NOC)C3=COC=C3)COC(=O)N

DOS

IR

Vibrations