Geometry & MOs

Info

ID:	277045
PubChem CID:	103826409
Reduced:	BrClNO3C14H15 (1)
Stoich.:	ABCD3E14F15 (1)
Weight, g/mol:	358.00837
ΔH_f, kcal/mol:	-120.53
Dipole, Da:	4.44
IP(EA), eV:	-9.74(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-5-chloro-N-methyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzamide

Drug info:

PubChemData

Smile

COC(=O)C1CCN(CC1)C(=O)C2=CC(=CC(=C2)Br)Cl

DOS

IR

Vibrations