Geometry & MOs

Info

ID:	304414
PubChem CID:	124587685
Reduced:	O3N5C20H27 (1)
Stoich.:	A3B5C20D27 (1)
Weight, g/mol:	268.088164
ΔH_f, kcal/mol:	-52.42
Dipole, Da:	2.91
IP(EA), eV:	-8.62(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(3S)-1-cyclopropylsulfonylpyrrolidin-3-yl]oxypyridine

Drug info:

PubChemData

Smile

CCN(C[C@@H]1COC2=CC=CC=C2O1)C(=O)C3=C(N(N=N3)C4CCNCC4)C

DOS

IR

Vibrations