Geometry & MOs

Info

ID:	277141
PubChem CID:	103826966
Reduced:	BrClON2C15H18 (1)
Stoich.:	ABCD2E15F18 (1)
Weight, g/mol:	329.0182
ΔH_f, kcal/mol:	-27.99
Dipole, Da:	4.62
IP(EA), eV:	-8.91(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-bromo-5-chlorophenyl)-(3-propylpyrrolidin-1-yl)methanone

Drug info:

PubChemData

Smile

CC1CN2CCCC2CN1C(=O)C3=CC(=CC(=C3)Br)Cl

DOS

IR

Vibrations