Geometry & MOs

Info

ID:	346489
PubChem CID:	127270993
Reduced:	OSN6C14H24 (1)
Stoich.:	ABC6D14E24 (1)
Weight, g/mol:	335.257277
ΔH_f, kcal/mol:	20.77
Dipole, Da:	9.92
IP(EA), eV:	-9.28(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-oxo-1-[2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]propan-2-yl]cyclohexanecarboxamide

Drug info:

PubChemData

Smile

CN1C(=NN=N1)SCCC(=O)N2CCCC2CN3CCCC3

DOS

IR

Vibrations