Geometry & MOs

Info

ID:	436369
PubChem CID:	135199410
Reduced:	FN2O6C24H29 (1)
Stoich.:	AB2C6D24E29 (1)
Weight, g/mol:	414.215472
ΔH_f, kcal/mol:	-269.08
Dipole, Da:	6.67
IP(EA), eV:	-9.06(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S,3S)-4-methyl-3-(3-methylphenyl)pentan-2-yl] (2S)-2-[(3-hydroxy-4-methoxypyridine-2-carbonyl)amino]propanoate

Drug info:

PubChemData

Smile

C[C@@H](C(=O)OC(C)C(C1=CC=C(C=C1)F)C(C)C)NC(=O)C2=NC=CC(=C2OC(=O)C)OC

DOS

IR

Vibrations