Geometry & MOs

Info

ID:	283627
PubChem CID:	103994443
Reduced:	N2O3C12H20 (1)
Stoich.:	A2B3C12D20 (1)
Weight, g/mol:	308.134777
ΔH_f, kcal/mol:	-139.3
Dipole, Da:	1.81
IP(EA), eV:	-9.46(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(cyclohexen-1-yl)ethylcarbamoyl-(2,2,2-trifluoroethyl)amino]acetic acid

Drug info:

PubChemData

Smile

CN(CC(=O)O)C(=O)NCCC1=CCCCC1

DOS

IR

Vibrations