Geometry & MOs

Info

ID:	56717
PubChem CID:	22388869
Reduced:	C2H3 (6)
Stoich.:	A2B3 (6)
Weight, g/mol:	240.082016
ΔH_f, kcal/mol:	-9.67
Dipole, Da:	0.75
IP(EA), eV:	-8.25(0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-benzylsulfanyl-3-hydroxypentanoic acid

Drug info:

PubChemData

Smile

CCC1CCC2=C(C1)C=C(C2)C

DOS

IR

Vibrations