Geometry & MOs

Info

ID:	288946
PubChem CID:	104328818
Reduced:	FON2C12H17 (1)
Stoich.:	ABC2D12E17 (1)
Weight, g/mol:	264.163791
ΔH_f, kcal/mol:	-91.33
Dipole, Da:	3.91
IP(EA), eV:	-9.28(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(aminomethyl)cyclohexyl]-4-fluoro-2-methylbenzamide

Drug info:

PubChemData

Smile

CCC(CNC(=O)C1=C(C=C(C=C1)F)C)N

DOS

IR

Vibrations