Geometry & MOs

Info

ID:	313145
PubChem CID:	126612230
Reduced:	NOH53C70 (1)
Stoich.:	ABC53D70 (1)
Weight, g/mol:	589.215412
ΔH_f, kcal/mol:	185.72
Dipole, Da:	3.04
IP(EA), eV:	-7.76(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,8-di(carbazol-9-yl)-10-phenylphenoxazine

Drug info:

Smile

CC1=CC(=C(C=C1)N2C3=C(C=CC(=C3)C4=CC5=C(C=C4)C6=C(C5(C)C)C=C(C7=CC=CC=C76)C8=CC=CC=C8)OC9=C2C=C(C=C9)C1=CC2=C(C=C1)C1=C(C2(C)C)C=C(C2=CC=CC=C21)C1=CC=CC=C1)C

DOS

IR

Vibrations