Geometry & MOs

Info

ID:	325126
PubChem CID:	126681150
Reduced:	ON2H36C49 (1)
Stoich.:	AB2C36D49 (1)
Weight, g/mol:	618.267114
ΔH_f, kcal/mol:	151.35
Dipole, Da:	3.29
IP(EA), eV:	-7.98(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1(C2=C(C=C(C=C2)N(C3=CC=C(C=C3)C4=CC5=C(C=C4)N(C6=CC=CC=C65)C7=CC=CC=C7)C8=CC9=CC=CC=C9C=C8)OC2=CC=CC=C21)C

DOS

IR

Vibrations