Geometry & MOs

Info

ID:	79257
PubChem CID:	49747703
Reduced:	ON3C16H21 (1)
Stoich.:	AB3C16D21 (1)
Weight, g/mol:	331.150761
ΔH_f, kcal/mol:	20.43
Dipole, Da:	3.56
IP(EA), eV:	-9.05(0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(dimethylamino)-2-(4-methylphenyl)ethyl]-N'-(2,2,2-trifluoroethyl)oxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(CNC(=O)C2(CC2)C#N)N(C)C

DOS

IR

Vibrations