Geometry & MOs

Info

ID:	316075
PubChem CID:	126629942
Reduced:	N5O5C28H43 (1)
Stoich.:	A5B5C28D43 (1)
Weight, g/mol:	326.209324
ΔH_f, kcal/mol:	-208.54
Dipole, Da:	6.84
IP(EA), eV:	-8.78(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-methyl-2-[2-methyl-2-(2-methylprop-2-enoyloxy)butoxy]butyl] 2-methylprop-2-enoate

Drug info:

PubChemData

Smile

C[C@@H](C(=O)N1CCC[C@H](N1)C(=O)N[C@@H](C2=CC(=CC=C2)OCC=C)C(C)C)NC(=O)[C@H](C(C)C)NC(=O)C

DOS

IR

Vibrations