Geometry & MOs

Info

ID:	122488
PubChem CID:	50808808
Reduced:	N2O2C17H22 (1)
Stoich.:	A2B2C17D22 (1)
Weight, g/mol:	366.0743
ΔH_f, kcal/mol:	-18.29
Dipole, Da:	3.59
IP(EA), eV:	-8.65(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[1-[(5-bromo-2-fluorophenyl)methyl]pyrrolidin-2-yl]-5-ethyl-3-methyl-1,2-oxazole

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)C2CCCN2CC3=CC=C(C=C3)OC

DOS

IR

Vibrations