Geometry & MOs

Info

ID:	407834
PubChem CID:	135080589
Reduced:	O2C7H10 (1)
Stoich.:	A2B7C10 (1)
Weight, g/mol:	197.94471
ΔH_f, kcal/mol:	-86.87
Dipole, Da:	0.87
IP(EA), eV:	-10.03(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-(bromomethyl)-2-chlorobut-3-en-1-ol

Drug info:

PubChemData

Smile

C/C=C\1/C(CCC1=O)O

DOS

IR

Vibrations