Geometry & MOs

Info

ID:	288672
PubChem CID:	104323282
Reduced:	ON6C13H22 (1)
Stoich.:	AB6C13D22 (1)
Weight, g/mol:	223.193614
ΔH_f, kcal/mol:	-10.38
Dipole, Da:	4.3
IP(EA), eV:	-8.88(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-methylcyclohexyl)-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-4-ol

Drug info:

PubChemData

Smile

CN(C)C1=NC(=NC(=N1)N)CN2CC3CCC(C3C2)O

DOS

IR

Vibrations