Geometry & MOs

Info

ID:	339592
PubChem CID:	127261582
Reduced:	BrO4C11H15 (1)
Stoich.:	AB4C11D15 (1)
Weight, g/mol:	325.167794
ΔH_f, kcal/mol:	-165.91
Dipole, Da:	7.74
IP(EA), eV:	-10.03(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-benzamidophenyl)methyl hexanoate

Drug info:

PubChemData

Smile

CCCCCC(=O)OC1=C(C(=O)OC1C)Br

DOS

IR

Vibrations