Geometry & MOs

Info

ID:	187702
PubChem CID:	77612459
Reduced:	BrO3C4H7 (2)
Stoich.:	AB3C4D7 (2)
Weight, g/mol:	306.080491
ΔH_f, kcal/mol:	-271.85
Dipole, Da:	2.75
IP(EA), eV:	-10.41(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-amino-2,3-dihydro-1H-inden-1-yl)-N-(2-hydroxyethyl)methanesulfonamide;hydrochloride

Drug info:

PubChemData

Smile

C(CBr)OC1(C(C(C(C(O1)CO)O)O)O)Br

DOS

IR

Vibrations