Geometry & MOs

Info

ID:	279136
PubChem CID:	103841621
Reduced:	BrClO2N3C14H17 (1)
Stoich.:	ABC2D3E14F17 (1)
Weight, g/mol:	358.04475
ΔH_f, kcal/mol:	-73.11
Dipole, Da:	7.75
IP(EA), eV:	-9.09(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-4-chloro-N-[[1-(dimethylamino)cyclopentyl]methyl]benzamide

Drug info:

PubChemData

Smile

C1CN(CCC1NC(=O)C2=CC(=C(C=C2)Cl)Br)CC(=O)N

DOS

IR

Vibrations