Geometry & MOs

Info

ID:	27060
PubChem CID:	814097
Reduced:	ClSO2N3C16H16 (1)
Stoich.:	ABC2D3E16F16 (1)
Weight, g/mol:	295.135448
ΔH_f, kcal/mol:	-18.44
Dipole, Da:	4.87
IP(EA), eV:	-9.01(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexyl-N-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]propanamide

Drug info:

PubChemData

Smile

CC1=CN=C(S1)NC(=O)CN(CC=C)C(=O)C2=CC=CC=C2Cl

DOS

IR

Vibrations