Geometry & MOs

Info

ID:	370775
PubChem CID:	127340555
Reduced:	SN3O3C19H35 (1)
Stoich.:	AB3C3D19E35 (1)
Weight, g/mol:	349.272927
ΔH_f, kcal/mol:	-159.87
Dipole, Da:	5.1
IP(EA), eV:	-8.85(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(4-cyclopentyl-1,4-diazepan-1-yl)-1-oxopropan-2-yl]cyclohexanecarboxamide

Drug info:

PubChemData

Smile

CCCS(=O)(=O)N1CCCCC1C(=O)N2CCCN(CC2)C3CCCC3

DOS

IR

Vibrations