Geometry & MOs

Info

ID:	329847
PubChem CID:	127246714
Reduced:	ON5C18H19 (1)
Stoich.:	AB5C18D19 (1)
Weight, g/mol:	330.169191
ΔH_f, kcal/mol:	39.11
Dipole, Da:	5.33
IP(EA), eV:	-8.65(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-methoxy-1,2-oxazol-5-yl)-1-[2-[2-(methylamino)pyridin-4-yl]pyrrolidin-1-yl]propan-1-one

Drug info:

PubChemData

Smile

CNC1=NC=CC(=C1)C2CCCN2C(=O)C3=CC4=C(C=C3)N=CN4

DOS

IR

Vibrations