Geometry & MOs

Info

ID:	303413
PubChem CID:	124489678
Reduced:	FON2C14H19 (1)
Stoich.:	ABC2D14E19 (1)
Weight, g/mol:	250.148141
ΔH_f, kcal/mol:	-86.82
Dipole, Da:	3.38
IP(EA), eV:	-9.11(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-fluoro-3-methyl-N-[(3S,4S)-4-methylpiperidin-3-yl]benzamide

Drug info:

PubChemData

Smile

C[C@@H]1CCNC[C@@H]1NC(=O)C2=C(C=CC(=C2)C)F

DOS

IR

Vibrations