Geometry & MOs

Info

ID:	141039
PubChem CID:	52807833
Reduced:	FN2O3H21C23 (1)
Stoich.:	AB2C3D21E23 (1)
Weight, g/mol:	233.118257
ΔH_f, kcal/mol:	-100.72
Dipole, Da:	3.16
IP(EA), eV:	-9.09(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-[2-[(1S,2R)-2-methylcyclohexyl]oxyethyl]acetamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)OC2=CC=CC=C2C(=O)NCCNC(=O)CC3=CC=C(C=C3)F

DOS

IR

Vibrations