Geometry & MOs

Info

ID:	347068
PubChem CID:	127271572
Reduced:	ON2C11H15 (2)
Stoich.:	AB2C11D15 (2)
Weight, g/mol:	386.211804
ΔH_f, kcal/mol:	-49.35
Dipole, Da:	3.64
IP(EA), eV:	-8.96(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[2-(4-fluorophenyl)-1,3-oxazol-4-yl]ethyl]-3-pyrrolidin-1-ylpiperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=NC(=CO2)CCNC(=O)N3CCCC(C3)N4CCCC4

DOS

IR

Vibrations