Geometry & MOs

Info

ID:	357242
PubChem CID:	127293758
Reduced:	O3N5C21H27 (1)
Stoich.:	A3B5C21D27 (1)
Weight, g/mol:	365.177313
ΔH_f, kcal/mol:	-81.5
Dipole, Da:	8.91
IP(EA), eV:	-8.63(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(oxan-3-yl)-2-[1-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]cyclohexyl]acetamide

Drug info:

PubChemData

Smile

CC1(CC2=C(C=C(C(=O)N2)C(=O)N3CCN(CC3)CC4=CN(N=C4)C)C(=O)C1)C

DOS

IR

Vibrations