Geometry & MOs

Info

ID:	333607
PubChem CID:	127252159
Reduced:	FSO2N3C24H28 (1)
Stoich.:	ABC2D3E24F28 (1)
Weight, g/mol:	376.189926
ΔH_f, kcal/mol:	-64.03
Dipole, Da:	1.27
IP(EA), eV:	-8.96(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-3-[(3-phenyl-1,2-oxazol-5-yl)methyl]-1-(pyridin-3-ylmethyl)pyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)C2(CCCN(CC2)CC3=CN=CC=C3)O)CCOC4=CC=C(C=C4)F

DOS

IR

Vibrations