Geometry & MOs

Info

ID:	124230
PubChem CID:	50875871
Reduced:	N2O3C19H22 (1)
Stoich.:	A2B3C19D22 (1)
Weight, g/mol:	281.119798
ΔH_f, kcal/mol:	-87.19
Dipole, Da:	6.6
IP(EA), eV:	-8.64(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-oxo-3-(1,3-thiazol-2-ylamino)propyl]cyclohexanecarboxamide

Drug info:

PubChemData

Smile

CC(C)C(=O)NC1=C(C=CC(=C1)C(=O)N(C)C2=CC=CC=C2)OC

DOS

IR

Vibrations