Geometry & MOs

Info

ID:	202868
PubChem CID:	79735850
Reduced:	BrOF4H5C13 (1)
Stoich.:	ABC4D5E13 (1)
Weight, g/mol:	254.04186
ΔH_f, kcal/mol:	-165.14
Dipole, Da:	3.4
IP(EA), eV:	-10.11(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-bromo-4-methylphenyl)pyrrolidin-3-amine

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1C(=O)C2=C(C=C(C=C2F)F)F)Br)F

DOS

IR

Vibrations