Geometry & MOs

Info

ID:	405603
PubChem CID:	135074620
Reduced:	OC17H20 (1)
Stoich.:	AB17C20 (1)
Weight, g/mol:	315.9823
ΔH_f, kcal/mol:	-5.05
Dipole, Da:	3.11
IP(EA), eV:	-9.47(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-N-[(E)-2,2,2-trifluoroethylideneamino]naphthalen-2-amine

Drug info:

PubChemData

Smile

C=CCC1CCCC/C(=C\C2=CC=CC=C2)/C1=O

DOS

IR

Vibrations