Geometry & MOs

Info

ID:	267324
PubChem CID:	103581814
Reduced:	BrClSN2O2C14H14 (1)
Stoich.:	ABCD2E2F14G14 (1)
Weight, g/mol:	366.01345
ΔH_f, kcal/mol:	-43.37
Dipole, Da:	3.89
IP(EA), eV:	-8.52(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[(4-bromo-3-chlorophenyl)methylamino]phenyl]-N-methylacetamide

Drug info:

PubChemData

Smile

CS(=O)(=O)NC1=CC=CC(=C1)NCC2=CC(=C(C=C2)Br)Cl

DOS

IR

Vibrations