Geometry & MOs

Info

ID:	36562
PubChem CID:	8008832
Reduced:	N2O2C21H26 (1)
Stoich.:	A2B2C21D26 (1)
Weight, g/mol:	362.179442
ΔH_f, kcal/mol:	-87.97
Dipole, Da:	5.01
IP(EA), eV:	-8.54(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-[(2-fluorophenyl)methyl-methylamino]-N-(2-phenylphenyl)propanamide

Drug info:

PubChemData

Smile

C1[C@@H]2CC3(C[C@H]1CC(C2)(C3)O)C(=O)NCCC4=CNC5=CC=CC=C54

DOS

IR

Vibrations