Geometry & MOs

Info

ID:	197832
PubChem CID:	79005457
Reduced:	O2N3C16H21 (1)
Stoich.:	A2B3C16D21 (1)
Weight, g/mol:	295.13322
ΔH_f, kcal/mol:	-42.82
Dipole, Da:	2.74
IP(EA), eV:	-8.92(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,2-dimethylpiperidin-4-yl)-3-fluoro-4-nitrobenzamide

Drug info:

PubChemData

Smile

CC1CC(CCN1C)NC(=O)COC2=CC=C(C=C2)C#N

DOS

IR

Vibrations