Geometry & MOs

Info

ID:	440986
PubChem CID:	135232587
Reduced:	N2O2H34C49 (1)
Stoich.:	A2B2C34D49 (1)
Weight, g/mol:	529.204179
ΔH_f, kcal/mol:	140.97
Dipole, Da:	3.11
IP(EA), eV:	-7.93(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-benzhydryl-6-(N-phenylanilino)xanthen-9-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC=C(C=C3)C4=CC5=C(C=C4)C(=O)C6=C(C=CC=C6O5)C7=CC=C(C=C7)N(C8=CC=CC=C8)C9=CC=CC=C9

DOS

IR

Vibrations