Geometry & MOs

Info

ID:	381903
PubChem CID:	134972765
Reduced:	BrO12C33H33 (1)
Stoich.:	AB12C33D33 (1)
Weight, g/mol:	238.120509
ΔH_f, kcal/mol:	-361.82
Dipole, Da:	5.58
IP(EA), eV:	-7.83(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2R)-2-(1-ethoxyethoxy)-2-phenylacetate

Drug info:

PubChemData

Smile

COC1=CC(=C(C2=C(C3=CC4=C(C(=C3C(=C12)OC)OC)C(=O)C(C5=CC(=C(C(=C54)OC)C(=O)OC)OC)(OC)OC)OC)Br)OC

DOS

IR

Vibrations