Geometry & MOs

Info

ID:

43814

PubChem CID:

10321825

Reduced:

SN4O5C22H24 (1)

Stoich.:

AB4C5D22E24 (1)

Weight, g/mol:

456.146741

ΔHf, kcal/mol:

-134.79

Dipole, Da:

7.66

IP(EA), eV:

 -9.58(-0.79)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[(4S,6S,7R,8S)-11-amino-12-(benzylsulfanylmethyl)-7-methoxy-10,13-dioxo-2,5-diazatetracyclo[7.4.0.02,7.04,6]trideca-1(9),11-dien-8-yl]methyl carbamate

Drug info:

PubChemData

Smile

CC(C)(C)OC[C@H]1C(=O)C(C(=O)N1CC2=CC=NC=C2)C3=NS(=O)(=O)C4=CC=CC=C4N3

DOS

IR

Vibrations