Geometry & MOs

Info

ID:	144553
PubChem CID:	53384726
Reduced:	Cl2S2O3N4C18H18 (1)
Stoich.:	A2B2C3D4E18F18 (1)
Weight, g/mol:	402.095805
ΔH_f, kcal/mol:	-61.05
Dipole, Da:	7.15
IP(EA), eV:	-9.02(-1.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-chlorophenyl)-N-[2-(dimethylamino)phenyl]acetamide;2,2,2-trifluoroacetic acid

Drug info:

PubChemData

Smile

CC(=O)N1CCN(CC1)NC(=O)CN2C(=O)/C(=C/C3=C(C=CC=C3Cl)Cl)/SC2=S

DOS

IR

Vibrations