Geometry & MOs

Info

ID:	391211
PubChem CID:	135003541
Reduced:	SiN2O12C49H74 (1)
Stoich.:	AB2C12D49E74 (1)
Weight, g/mol:	267.147058
ΔH_f, kcal/mol:	-616.48
Dipole, Da:	6.66
IP(EA), eV:	-8.71(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl 4-methyl-1-(2-methylpropyl)-4H-pyridine-2,3-dicarboxylate

Drug info:

Smile

CC(C)(C)C(=O)OCC1[C@@H](C(C([C@@H](O1)N(C=O)C(CC2=CC=CC=C2)C(=O)NC3=CC=CC=C3CO[Si](C)(C)C(C)(C)C)OC(=O)C(C)(C)C)OC(=O)C(C)(C)C)OC(=O)C(C)(C)C

DOS

IR

Vibrations