Geometry & MOs

Info

ID:	81993
PubChem CID:	49855451
Reduced:	BrPO7C16H28 (1)
Stoich.:	ABC7D16E28 (1)
Weight, g/mol:	380.160005
ΔH_f, kcal/mol:	-403.48
Dipole, Da:	5.36
IP(EA), eV:	-9.93(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2,2-dimethylpropanoyloxymethoxy-[(3-methyloxiran-2-yl)methyl]phosphoryl]oxymethyl 2,2-dimethylpropanoate

Drug info:

PubChemData

Smile

CC(C)(C)C(=O)OCOP(=O)(C/C=C/CBr)OCOC(=O)C(C)(C)C

DOS

IR

Vibrations