Geometry & MOs

Info

ID:	202629
PubChem CID:	79701890
Reduced:	BrFNC15H21 (1)
Stoich.:	ABCD15E21 (1)
Weight, g/mol:	356.10994
ΔH_f, kcal/mol:	-63.64
Dipole, Da:	4.64
IP(EA), eV:	-9.46(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-bromo-2,5-dimethoxyphenyl)methyl]-N-methyl-1-piperidin-4-ylmethanamine

Drug info:

PubChemData

Smile

CC1(CCC(CC1)(CC2=CC(=CC(=C2)Br)F)N)C

DOS

IR

Vibrations