Geometry & MOs

Info

ID:	417372
PubChem CID:	135092907
Reduced:	FN7C14H18 (1)
Stoich.:	AB7C14D18 (1)
Weight, g/mol:	376.191069
ΔH_f, kcal/mol:	50.51
Dipole, Da:	3.39
IP(EA), eV:	-8.62(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(dimethylamino)-5-(4-fluoro-3-methoxyphenyl)-N-[(2R,4S)-2-methylpiperidin-4-yl]-1,2-oxazole-4-carboxamide

Drug info:

PubChemData

Smile

CN(C)C1=NC(=NC=C1F)N2CCN(CC2)C3=NC=CN=C3

DOS

IR

Vibrations