Geometry & MOs

Info

ID:	372655
PubChem CID:	131301642
Reduced:	NOF3C10H12 (1)
Stoich.:	ABC3D10E12 (1)
Weight, g/mol:	303.01201
ΔH_f, kcal/mol:	-163.94
Dipole, Da:	4.6
IP(EA), eV:	-9.71(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-amino-4-iodo-7-methyl-2,3-dihydroinden-1-yl)methanol

Drug info:

PubChemData

Smile

CC1=CC(=C(O1)C(F)(F)F)[C@@H](C2CC2)N

DOS

IR

Vibrations