Geometry & MOs

Info

ID:	74271
PubChem CID:	48421660
Reduced:	NO2F3C16H20 (1)
Stoich.:	AB2C3D16E20 (1)
Weight, g/mol:	389.195071
ΔH_f, kcal/mol:	-217.85
Dipole, Da:	5.18
IP(EA), eV:	-9.67(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-oxo-1-[4-(oxolane-2-carbonyl)piperazin-1-yl]-3-phenylpropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C(=O)N(C)CC1=CC=C(C=C1)C(F)(F)F)OCC2CC2

DOS

IR

Vibrations