Geometry & MOs

Info

ID:

15576

PubChem CID:

444806

Reduced:

S2N5O6C14H19 (1)

Stoich.:

A2B5C6D14E19 (1)

Weight, g/mol:

417.077676

ΔHf, kcal/mol:

-169.65

Dipole, Da:

6.0

IP(EA), eV:

 -8.9(-1.22)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(2R)-2-[(R)-[[2-(2-amino-4,5-dihydro-1,3-thiazol-4-yl)-2-(methoxyamino)acetyl]amino]-carboxymethyl]-5-methyl-2H-1,3-thiazine-4-carboxylic acid

Drug info:

PubChemData

Smile

CC1=CS[C@@H](N=C1C(=O)O)[C@@H](C(=O)O)NC(=O)C(C2CSC(=N2)N)NOC

DOS

IR

Vibrations