Geometry & MOs

Info

ID:	194163
PubChem CID:	78492671
Reduced:	ClFNO3C18H21 (1)
Stoich.:	ABCD3E18F21 (1)
Weight, g/mol:	370.109563
ΔH_f, kcal/mol:	-162.02
Dipole, Da:	2.53
IP(EA), eV:	-9.27(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(cyclohexylcarbamoylamino)-1-oxopropan-2-yl] 2-chloro-6-fluorobenzoate

Drug info:

PubChemData

Smile

CC(C(=O)NCCC1=CCCCC1)OC(=O)C2=C(C=CC=C2Cl)F

DOS

IR

Vibrations