Geometry & MOs

Info

ID:	267264
PubChem CID:	103581576
Reduced:	BrClNOC11H15 (1)
Stoich.:	ABCDE11F15 (1)
Weight, g/mol:	330.04984
ΔH_f, kcal/mol:	-29.48
Dipole, Da:	3.12
IP(EA), eV:	-9.48(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-bromo-3-chlorophenyl)methyl]-1-(1-ethylpyrrolidin-3-yl)methanamine

Drug info:

PubChemData

Smile

CCOCCNCC1=CC(=C(C=C1)Br)Cl

DOS

IR

Vibrations