Geometry & MOs

Info

ID:	48916
PubChem CID:	11528473
Reduced:	N2C5H5 (2)
Stoich.:	A2B5C5 (2)
Weight, g/mol:	186.115698
ΔH_f, kcal/mol:	105.07
Dipole, Da:	4.76
IP(EA), eV:	-8.65(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,2R)-1-amino-2-phenylcyclopentane-1-carbonitrile

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=CN2)CCN=[N+]=[N-]

DOS

IR

Vibrations