Geometry & MOs

Info

ID:	312363
PubChem CID:	126604451
Reduced:	BrNC21H24 (1)
Stoich.:	ABC21D24 (1)
Weight, g/mol:	336.162649
ΔH_f, kcal/mol:	64.47
Dipole, Da:	4.69
IP(EA), eV:	-7.84(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-ethylnaphthalen-1-yl)-2,3-dihydro-1,10-phenanthroline

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N(C2=CCC3CCC3=C2)/C(=C/C=C(\C)/Br)/C

DOS

IR

Vibrations