Geometry & MOs

Info

ID:	234517
PubChem CID:	92298597
Reduced:	OI2N2H18C21 (1)
Stoich.:	AB2C2D18E21 (1)
Weight, g/mol:	567.95086
ΔH_f, kcal/mol:	63.1
Dipole, Da:	3.68
IP(EA), eV:	-8.64(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-1-anilino-3-(3,6-diiodocarbazol-9-yl)propan-2-ol

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)NC[C@@H](CN2C3=C(C=C(C=C3)I)C4=C2C=CC(=C4)I)O

DOS

IR

Vibrations