Geometry & MOs

Info

ID:	325127
PubChem CID:	126681151
Reduced:	ON2H34C45 (1)
Stoich.:	AB2C34D45 (1)
Weight, g/mol:	695.293663
ΔH_f, kcal/mol:	135.21
Dipole, Da:	2.33
IP(EA), eV:	-7.92(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-pyridin-2-ylphenyl)xanthen-3-amine

Drug info:

PubChemData

Smile

CC1(C2=C(C=C(C=C2)N(C3=CC=CC=C3)C4=CC=C(C=C4)C5=CC6=C(C=C5)N(C7=CC=CC=C76)C8=CC=CC=C8)OC9=CC=CC=C91)C

DOS

IR

Vibrations