Geometry & MOs

Info

ID:

440356

PubChem CID:

135230315

Reduced:

FON5H15C16 (2)

Stoich.:

ABC5D15E16 (2)

Weight, g/mol:

621.251124

ΔHf, kcal/mol:

63.95

Dipole, Da:

4.03

IP(EA), eV:

 -8.95(-0.89)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

5-[5-[[(4R,5S)-5-(3,4-difluorophenyl)-2-(2-methoxyethyl)-1,2-oxazolidin-4-yl]carbamoylamino]-4-methyl-1-phenylpyrazol-3-yl]-N,1-dimethyl-2-oxopyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(N(N=C1C2=CN=C3C(=C2)C=NN3C)C4=CC=CC=C4)NC(=O)N[C@@H]5CN(O[C@H]5C6=CC(=C(C=C6)F)F)CC7=CN(N=C7)C

DOS

IR

Vibrations