Geometry & MOs

Info

ID:	47838
PubChem CID:	10535559
Reduced:	N2O2C9H18 (1)
Stoich.:	A2B2C9D18 (1)
Weight, g/mol:	186.115698
ΔH_f, kcal/mol:	-100.87
Dipole, Da:	2.64
IP(EA), eV:	-9.05(1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopentylamino)benzonitrile

Drug info:

PubChemData

Smile

CNCCCNC(=O)C1CCCO1

DOS

IR

Vibrations