Geometry & MOs

Info

ID:	262115
PubChem CID:	103271396
Reduced:	NOC12H25 (1)
Stoich.:	ABC12D25 (1)
Weight, g/mol:	285.184112
ΔH_f, kcal/mol:	-94.01
Dipole, Da:	3.61
IP(EA), eV:	-8.93(2.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[1-(1-phenylpyrazol-4-yl)ethylamino]methyl]cyclopentan-1-ol

Drug info:

PubChemData

Smile

CCCCC(C)NCC1CCC(C1)O

DOS

IR

Vibrations