Geometry & MOs

Info

ID:	74535
PubChem CID:	48422033
Reduced:	NO2C15H25 (1)
Stoich.:	AB2C15D25 (1)
Weight, g/mol:	373.161326
ΔH_f, kcal/mol:	-90.9
Dipole, Da:	3.24
IP(EA), eV:	-9.19(1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-oxo-3-phenyl-1-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]propan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C(=O)NCCC1=CCCCC1)OCC2CC2

DOS

IR

Vibrations