Geometry & MOs

Info

ID:	276653
PubChem CID:	103824596
Reduced:	BrClNOSH7C11 (1)
Stoich.:	ABCDEF7G11 (1)
Weight, g/mol:	326.06299
ΔH_f, kcal/mol:	11.83
Dipole, Da:	6.14
IP(EA), eV:	-9.14(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-N-[2,2-dimethyl-3-(methylamino)-3-oxopropyl]-4-methylbenzamide

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1NC(=O)C2=CSC=C2)Cl)Br

DOS

IR

Vibrations