Geometry & MOs

Info

ID:	209612
PubChem CID:	80694042
Reduced:	FNOC8H16 (1)
Stoich.:	ABCD8E16 (1)
Weight, g/mol:	241.02814
ΔH_f, kcal/mol:	-113.91
Dipole, Da:	2.59
IP(EA), eV:	-9.2(2.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-(2-fluoroethyl)-3-(trifluoromethyl)aniline

Drug info:

PubChemData

Smile

C1CCC(C1)(CO)NCCF

DOS

IR

Vibrations