Geometry & MOs

Info

ID:	169804
PubChem CID:	75152233
Reduced:	NO7C14H21 (1)
Stoich.:	AB7C14D21 (1)
Weight, g/mol:	298.120509
ΔH_f, kcal/mol:	-334.67
Dipole, Da:	4.33
IP(EA), eV:	-10.55(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl 2-benzyl-2-hydroxy-3-oxobutanoate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)C1(CC(=O)N(C1=O)C(=O)OC(C)(C)C)O

DOS

IR

Vibrations