Geometry & MOs

Info

ID:	148896
PubChem CID:	53788566
Reduced:	SN2O3C16H16 (1)
Stoich.:	AB2C3D16E16 (1)
Weight, g/mol:	289.103355
ΔH_f, kcal/mol:	-60.19
Dipole, Da:	5.56
IP(EA), eV:	-8.89(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R)-1-(2-chlorophenyl)propan-2-yl]-2-(2-fluorophenyl)ethanimine

Drug info:

PubChemData

Smile

CN(C1=CC=CC=C1)C(=O)OC2=CC=CC(=C2)NC(=S)OC

DOS

IR

Vibrations