Geometry & MOs

Info

ID:	200824
PubChem CID:	79449387
Reduced:	BrFNC15H15 (1)
Stoich.:	ABCD15E15 (1)
Weight, g/mol:	327.11978
ΔH_f, kcal/mol:	-4.73
Dipole, Da:	1.85
IP(EA), eV:	-9.36(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-bromophenyl)-N-(2-methoxyethyl)-5-methylhexan-1-amine

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)CC(CN)C2=CC=CC=C2Br)F

DOS

IR

Vibrations