Geometry & MOs

Info

ID:	37387
PubChem CID:	8020444
Reduced:	NO3C17H23 (1)
Stoich.:	AB3C17D23 (1)
Weight, g/mol:	322.116486
ΔH_f, kcal/mol:	-122.11
Dipole, Da:	4.79
IP(EA), eV:	-8.67(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-(2-methoxy-4-nitroanilino)-1-oxopropan-2-yl] (1S,2S)-2-methylcyclopropane-1-carboxylate

Drug info:

PubChemData

Smile

C[C@@H]1C[C@@H]1C(=O)O[C@@H](C)C(=O)NC2=CC=C(C=C2)C(C)C

DOS

IR

Vibrations