Geometry & MOs

Info

ID:	267878
PubChem CID:	103590064
Reduced:	BrFN2C15H16 (1)
Stoich.:	ABC2D15E16 (1)
Weight, g/mol:	274.148141
ΔH_f, kcal/mol:	0.03
Dipole, Da:	2.15
IP(EA), eV:	-8.19(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-fluoro-1-N-[(4-methoxyphenyl)methyl]-1-N,5-dimethylbenzene-1,2-diamine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1F)N)N(C)CC2=CC=CC=C2Br

DOS

IR

Vibrations