Geometry & MOs

Info

ID:	35861
PubChem CID:	7980415
Reduced:	NO5H23C24 (1)
Stoich.:	AB5C23D24 (1)
Weight, g/mol:	348.168522
ΔH_f, kcal/mol:	-124.83
Dipole, Da:	2.98
IP(EA), eV:	-8.67(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[[(1R,2R)-2-methylcyclohexyl]carbamoylamino]-2-oxoethyl] 2-phenoxyacetate

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)C(=O)NCC(=O)OCC2=CC=CC=C2)OCC3=CC=CC=C3

DOS

IR

Vibrations