Geometry & MOs

Info

ID:	402340
PubChem CID:	135055574
Reduced:	NOC20H21 (1)
Stoich.:	ABC20D21 (1)
Weight, g/mol:	210.089209
ΔH_f, kcal/mol:	14.77
Dipole, Da:	2.13
IP(EA), eV:	-7.84(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,4S)-3,4,5-trihydroxy-5-phenylpentanal

Drug info:

PubChemData

Smile

C[C@H](CNC1=CC=C(C=C1)OC)C2=CC3=CC=CC=C3C=C2

DOS

IR

Vibrations