Geometry & MOs

Info

ID:	277083
PubChem CID:	103826643
Reduced:	BrClON2C15H20 (1)
Stoich.:	ABCD2E15F20 (1)
Weight, g/mol:	370.04475
ΔH_f, kcal/mol:	-34.07
Dipole, Da:	5.86
IP(EA), eV:	-8.93(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-bromo-5-chlorophenyl)-(3-pyrrolidin-1-ylpiperidin-1-yl)methanone

Drug info:

PubChemData

Smile

CN(C)CC1CCN(CC1)C(=O)C2=CC(=CC(=C2)Br)Cl

DOS

IR

Vibrations