Geometry & MOs

Info

ID:	311874
PubChem CID:	126598670
Reduced:	N2H40C45 (1)
Stoich.:	A2B40C45 (1)
Weight, g/mol:	487.18746
ΔH_f, kcal/mol:	117.18
Dipole, Da:	2.07
IP(EA), eV:	-7.92(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-bromo-1,1,2,2,3,3-hexamethylinden-5-yl)-9,9-dimethylfluoren-2-amine

Drug info:

PubChemData

Smile

CC1(C2=C(C=C3C(=C2)C4=C(N3)C=CC(=C4)C5=CC6=C(C=C5)N(C7=CC=CC=C76)C8=CC=CC(=C8)C9=CC=CC=C9)C(C1(C)C)(C)C)C

DOS

IR

Vibrations