Geometry & MOs

Info

ID:	185153
PubChem CID:	77262570
Reduced:	FN3O6C24H30 (1)
Stoich.:	AB3C6D24E30 (1)
Weight, g/mol:	473.198442
ΔH_f, kcal/mol:	-267.01
Dipole, Da:	3.03
IP(EA), eV:	-9.35(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(1,3-benzothiazole-2-carbonyl)-2-cyclohexyl-1-morpholin-4-yl-1-oxopentan-3-yl] carbamate

Drug info:

PubChemData

Smile

C1CCC(CC1)CC(C(=O)N2CCOCC2)NC(=O)OCC(=O)CC3=NC4=C(O3)C=CC(=C4)F

DOS

IR

Vibrations