Geometry & MOs

Info

ID:	293341
PubChem CID:	117385021
Reduced:	BrF2O2H7C8 (1)
Stoich.:	AB2C2D7E8 (1)
Weight, g/mol:	252.01498
ΔH_f, kcal/mol:	-158.19
Dipole, Da:	1.51
IP(EA), eV:	-9.59(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(7-bromo-2,3-dihydro-1H-inden-5-yl)cyclopropan-1-ol

Drug info:

PubChemData

Smile

C1=C(C(=C(C(=C1Br)O)F)F)CCO

DOS

IR

Vibrations