Geometry & MOs

Info

ID:	234056
PubChem CID:	92297632
Reduced:	OI2N2H20C22 (1)
Stoich.:	AB2C2D20E22 (1)
Weight, g/mol:	581.96651
ΔH_f, kcal/mol:	51.92
Dipole, Da:	3.56
IP(EA), eV:	-8.6(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)NC[C@@H](CN2C3=C(C=C(C=C3)I)C4=C2C=CC(=C4)I)O

DOS

IR

Vibrations