Geometry & MOs

Info

ID:	75779
PubChem CID:	48423970
Reduced:	N2O5C21H26 (1)
Stoich.:	A2B5C21D26 (1)
Weight, g/mol:	387.176976
ΔH_f, kcal/mol:	-173.45
Dipole, Da:	2.21
IP(EA), eV:	-8.99(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COCCOC1=CC=CC(=C1)CNC(=O)C(CC2=CC=CC=C2)NC(=O)OC

DOS

IR

Vibrations