Geometry & MOs

Info

ID:	289076
PubChem CID:	104334084
Reduced:	FSO2N3C12H18 (1)
Stoich.:	ABC2D3E12F18 (1)
Weight, g/mol:	292.153541
ΔH_f, kcal/mol:	-98.36
Dipole, Da:	5.29
IP(EA), eV:	-9.08(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(3-methylpiperidin-3-yl)methylamino]-3-nitrobenzamide

Drug info:

PubChemData

Smile

CC1(CCNCC1)CNS(=O)(=O)C2=CN=CC(=C2)F

DOS

IR

Vibrations