Geometry & MOs

Info

ID:	279978
PubChem CID:	103846013
Reduced:	NOSBr2C6H7 (1)
Stoich.:	ABCD2E6F7 (1)
Weight, g/mol:	218.98949
ΔH_f, kcal/mol:	-6.86
Dipole, Da:	2.22
IP(EA), eV:	-9.53(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-3-(3-bromofuran-2-yl)propan-1-ol

Drug info:

PubChemData

Smile

C1=C(SC(=C1Br)Br)C(CO)N

DOS

IR

Vibrations