Geometry & MOs

Info

ID:	440533
PubChem CID:	135230519
Reduced:	ON3C8H15 (1)
Stoich.:	AB3C8D15 (1)
Weight, g/mol:	668.230722
ΔH_f, kcal/mol:	-29.86
Dipole, Da:	6.46
IP(EA), eV:	-9.32(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC1=NC(=O)N(N1)C(C)(C)C

DOS

IR

Vibrations