Geometry & MOs

Info

ID:	279186
PubChem CID:	103841929
Reduced:	BrClON3H11C12 (1)
Stoich.:	ABCD3E11F12 (1)
Weight, g/mol:	315.00255
ΔH_f, kcal/mol:	10.0
Dipole, Da:	4.95
IP(EA), eV:	-8.99(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-bromo-4-chlorophenyl)-(2,2-dimethylpyrrolidin-1-yl)methanone

Drug info:

PubChemData

Smile

CC1=C(C(=NN1)C)NC(=O)C2=CC(=C(C=C2)Cl)Br

DOS

IR

Vibrations