Geometry & MOs

Info

ID:

311168

PubChem CID:

126589679

Reduced:

NO2C14H17 (1)

Stoich.:

AB2C14D17 (1)

Weight, g/mol:

492.180898

ΔHf, kcal/mol:

-66.29

Dipole, Da:

2.85

IP(EA), eV:

 -9.38(0.1)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-amino-N-[(23S)-10-ethyl-18-fluoro-10-hydroxy-19-methyl-5,9-dioxo-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaen-23-yl]acetamide

Drug info:

PubChemData

Smile

C/C=C\C1C(C2=CC=CC=C2C1OC(=O)N)C

DOS

IR

Vibrations