Geometry & MOs

Info

ID:	249768
PubChem CID:	103091948
Reduced:	BrNC11H14 (1)
Stoich.:	ABC11D14 (1)
Weight, g/mol:	193.126678
ΔH_f, kcal/mol:	20.95
Dipole, Da:	2.71
IP(EA), eV:	-9.34(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-4-(4-fluoro-3-methylphenyl)-3-methylbut-3-en-2-amine

Drug info:

PubChemData

Smile

CC(/C(=C/C1=CC=CC=C1Br)/C)N

DOS

IR

Vibrations