Geometry & MOs

Info

ID:	274337
PubChem CID:	103808614
Reduced:	ClFON2C11H14 (1)
Stoich.:	ABCD2E11F14 (1)
Weight, g/mol:	270.093519
ΔH_f, kcal/mol:	-92.15
Dipole, Da:	2.95
IP(EA), eV:	-9.27(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-N-(2-chloro-5-fluorophenyl)cyclohexane-1-carboxamide

Drug info:

PubChemData

Smile

CC(CC(=O)NC1=C(C=CC(=C1)F)Cl)CN

DOS

IR

Vibrations