Geometry & MOs

Info

ID:

436602

PubChem CID:

135205953

Reduced:

F4N4O5H24C29 (1)

Stoich.:

A4B4C5D24E29 (1)

Weight, g/mol:

584.118665

ΔHf, kcal/mol:

-313.97

Dipole, Da:

9.7

IP(EA), eV:

 -9.24(-1.29)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[4-[5-chloro-2-[5-(trifluoromethyl)-1,3,4-oxadiazol-2-yl]phenyl]-5-methoxy-2-oxopyridin-1-yl]-N-quinoxalin-6-ylbutanamide

Drug info:

PubChemData

Smile

C[C@@H](C(F)(F)F)N(CC1=CC=C(C=C1)F)C(=O)CN2CO[C@@]3(C2=O)C(=O)CC4=C3C=CC(=C4)NC(=O)C5=CC=CC=N5

DOS

IR

Vibrations