Geometry & MOs

Info

ID:	235342
PubChem CID:	92309484
Reduced:	SO2N3C22H25 (1)
Stoich.:	AB2C3D22E25 (1)
Weight, g/mol:	329.173942
ΔH_f, kcal/mol:	-26.04
Dipole, Da:	7.63
IP(EA), eV:	-8.3(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3-methylindazol-1-yl)-5-oxo-N-[[(2R)-oxolan-2-yl]methyl]pentanamide

Drug info:

PubChemData

Smile

C[C@@H](C1=C(SC2=C1CCCC2)N3C=CC=C3)NC(=O)NC4=CC=C(C=C4)OC

DOS

IR

Vibrations