Geometry & MOs

Info

ID:	80920
PubChem CID:	49853896
Reduced:	BNC6H14 (1)
Stoich.:	ABC6D14 (1)
Weight, g/mol:	462.14057
ΔH_f, kcal/mol:	-51.6
Dipole, Da:	1.74
IP(EA), eV:	-8.98(1.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(dimethoxy-lambda3-bromanyl)phenoxy]-1-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)ethanone

Drug info:

PubChemData

Smile

B1(CCCN1CC)C

DOS

IR

Vibrations