Geometry & MOs

Info

ID:	196539
PubChem CID:	78845709
Reduced:	NO3C19H27 (1)
Stoich.:	AB3C19D27 (1)
Weight, g/mol:	388.125692
ΔH_f, kcal/mol:	-142.96
Dipole, Da:	2.41
IP(EA), eV:	-9.37(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-benzothiazol-2-yl)-4-(4-fluorophenoxy)-N-(2-methoxyethyl)butanamide

Drug info:

PubChemData

Smile

CC(C)C1=CC=CC=C1OC(=O)C2CCN(CC2)C(=O)C(C)C

DOS

IR

Vibrations