Geometry & MOs

Info

ID:	17675
PubChem CID:	511394
Reduced:	BrPC3O5H6 (1)
Stoich.:	ABC3D5E6 (1)
Weight, g/mol:	231.91362
ΔH_f, kcal/mol:	-265.6
Dipole, Da:	4.84
IP(EA), eV:	-10.92(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-2-phosphonopropanoic acid

Drug info:

PubChemData

Smile

CC(C(=O)O)(P(=O)(O)O)Br

DOS

IR

Vibrations