Geometry & MOs

Info

ID:	396325
PubChem CID:	135028064
Reduced:	OC6H6 (3)
Stoich.:	AB6C6 (3)
Weight, g/mol:	284.141245
ΔH_f, kcal/mol:	-78.38
Dipole, Da:	2.67
IP(EA), eV:	-9.34(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzhydryl (3S)-4-hydroxy-3-methylbutanoate

Drug info:

PubChemData

Smile

C[C@@H](CC(=O)OC(C1=CC=CC=C1)C2=CC=CC=C2)C=O

DOS

IR

Vibrations