Geometry & MOs

Info

ID:	181460
PubChem CID:	76747733
Reduced:	SO4N6C20H24 (1)
Stoich.:	AB4C6D20E24 (1)
Weight, g/mol:	352.171082
ΔH_f, kcal/mol:	-84.81
Dipole, Da:	3.92
IP(EA), eV:	-8.66(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[2-(2-amino-4,5-dihydro-1,3-oxazol-4-yl)ethyl]phenyl]-4,4-difluoropiperidine-1-carboxamide

Drug info:

PubChemData

Smile

C1CS(=O)(=O)CCN1C2=NC=C(N=C2)C(=O)NC3=CC=C(C=C3)CCC4COC(=N4)N

DOS

IR

Vibrations