Geometry & MOs

Info

ID:	32509
PubChem CID:	7840338
Reduced:	NO4H23C24 (1)
Stoich.:	AB4C23D24 (1)
Weight, g/mol:	348.168522
ΔH_f, kcal/mol:	-121.48
Dipole, Da:	2.88
IP(EA), eV:	-8.6(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-(cyclohexylcarbamoylamino)-1-oxopropan-2-yl] 2-hydroxy-3-methylbenzoate

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)NC(=O)[C@@H](C2=CC=CC=C2)OC(=O)C3=CC=CC(=C3O)C

DOS

IR

Vibrations