Geometry & MOs

Info

ID:	262106
PubChem CID:	103270901
Reduced:	NOC15H23 (1)
Stoich.:	ABC15D23 (1)
Weight, g/mol:	284.09277
ΔH_f, kcal/mol:	-56.88
Dipole, Da:	3.41
IP(EA), eV:	-8.92(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[(2-chloro-4-nitrophenyl)methylamino]methyl]cyclopentan-1-ol

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C)CNCC2CCC(C2)O

DOS

IR

Vibrations