Geometry & MOs

Info

ID:	197667
PubChem CID:	78985868
Reduced:	BrOSN3H8C9 (1)
Stoich.:	ABCD3E8F9 (1)
Weight, g/mol:	376.90435
ΔH_f, kcal/mol:	28.05
Dipole, Da:	4.05
IP(EA), eV:	-9.48(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-bromothiophen-2-yl)methyl]-2-(3,4-dichlorophenyl)acetamide

Drug info:

PubChemData

Smile

C1=CSC(=C1Br)CNC(=O)C2=CC=NN2

DOS

IR

Vibrations