Geometry & MOs

Info

ID:	201734
PubChem CID:	79572621
Reduced:	O2N3C16H27 (1)
Stoich.:	A2B3C16D27 (1)
Weight, g/mol:	229.157898
ΔH_f, kcal/mol:	-80.85
Dipole, Da:	3.28
IP(EA), eV:	-8.95(0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-indazol-1-ylethyl)cyclopentan-1-amine

Drug info:

PubChemData

Smile

CCNC1(CCCC1CCN2C=C(C=N2)C)C(=O)OCC

DOS

IR

Vibrations