Geometry & MOs

Info

ID:	279165
PubChem CID:	103841789
Reduced:	BrClON2C13H16 (1)
Stoich.:	ABCD2E13F16 (1)
Weight, g/mol:	330.01345
ΔH_f, kcal/mol:	-2.3
Dipole, Da:	3.84
IP(EA), eV:	-8.98(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-4-chloro-N-[(1-methylpyrrolidin-2-yl)methyl]benzamide

Drug info:

PubChemData

Smile

CN(CCNC(=O)C1=CC(=C(C=C1)Cl)Br)C2CC2

DOS

IR

Vibrations