Geometry & MOs

Info

ID:	320923
PubChem CID:	126664254
Reduced:	O3N6C20H26 (1)
Stoich.:	A3B6C20D26 (1)
Weight, g/mol:	398.206639
ΔH_f, kcal/mol:	-54.1
Dipole, Da:	7.64
IP(EA), eV:	-8.44(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(1R)-1-[6-(1-tert-butylpyrazol-4-yl)-2,3-dimethylpyrazolo[4,3-c]pyridin-4-yl]oxyethyl]-1,3-oxazolidin-2-one

Drug info:

PubChemData

Smile

CC1=C2C(=NN1C)C=C(N=C2O[C@H](C)[C@H]3CNC(=O)O3)C4=CN(N=C4)C(C)(C)C

DOS

IR

Vibrations