Geometry & MOs

Info

ID:	426304
PubChem CID:	135143301
Reduced:	O2N3C19H23 (1)
Stoich.:	A2B3C19D23 (1)
Weight, g/mol:	499.23
ΔH_f, kcal/mol:	-4.42
Dipole, Da:	2.73
IP(EA), eV:	-8.76(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-cyclohexa-1,5-dien-1-yl-3-(10-phenyl-4a,10-dihydroanthracen-9-yl)carbazole

Drug info:

PubChemData

Smile

C/C=C(\C(=C/C)\O)/C(=O)/C=C/N1CC2CC1CN2C3=CC=CC=N3

DOS

IR

Vibrations