Geometry & MOs

Info

ID:	262072
PubChem CID:	103268186
Reduced:	NO2C11H19 (1)
Stoich.:	AB2C11D19 (1)
Weight, g/mol:	323.089991
ΔH_f, kcal/mol:	-77.94
Dipole, Da:	2.34
IP(EA), eV:	-9.32(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[3-chloro-5-(trifluoromethyl)anilino]hexanoate

Drug info:

PubChemData

Smile

CCC(=CCNCC(=C)C)C(=O)OC

DOS

IR

Vibrations