Geometry & MOs

Info

ID:	233128
PubChem CID:	87692439
Reduced:	O2C4H5 (2)
Stoich.:	A2B4C5 (2)
Weight, g/mol:	389.204967
ΔH_f, kcal/mol:	-81.7
Dipole, Da:	4.65
IP(EA), eV:	-9.24(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[(2-methylpropan-2-yl)oxy]-4-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-4-nitro-7-oxoheptanoic acid

Drug info:

PubChemData

Smile

C1CC23C(C1OCC4CO4)(O2)O3

DOS

IR

Vibrations