Geometry & MOs

Info

ID:	15291
PubChem CID:	436272
Reduced:	BrNOC26H34 (1)
Stoich.:	ABCD26E34 (1)
Weight, g/mol:	455.18238
ΔH_f, kcal/mol:	-28.27
Dipole, Da:	2.95
IP(EA), eV:	-8.64(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(9-bromophenanthren-1-yl)-2-(dipentylamino)ethanol

Drug info:

PubChemData

Smile

CCCCCN(CCCCC)CC(C1=CC=CC2=C1C=C(C3=CC=CC=C23)Br)O

DOS

IR

Vibrations