Geometry & MOs

Info

ID:	45938
PubChem CID:	10519412
Reduced:	NO2H17C21 (1)
Stoich.:	AB2C17D21 (1)
Weight, g/mol:	315.186585
ΔH_f, kcal/mol:	30.82
Dipole, Da:	2.71
IP(EA), eV:	-9.42(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2S)-3-[tert-butyl(dimethyl)silyl]oxy-2-[[(1R,2S)-2-methylcyclopropanecarbonyl]amino]propanoate

Drug info:

PubChemData

Smile

C1[C@@H]2C=C[C@H]1[C@@]3([C@H]2C4=CC=CC=C4)C(=O)OC(=N3)C5=CC=CC=C5

DOS

IR

Vibrations