Geometry & MOs

Info

ID:	255715
PubChem CID:	103134220
Reduced:	NO2H13C18 (1)
Stoich.:	AB2C13D18 (1)
Weight, g/mol:	222.173213
ΔH_f, kcal/mol:	10.45
Dipole, Da:	3.64
IP(EA), eV:	-9.06(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[cyclopentyl-[(5-methyloxolan-2-yl)methyl]amino]acetonitrile

Drug info:

PubChemData

Smile

C1C(OC2=CC=CC=C21)C(=O)C3=CC=CC4=C3C=NC=C4

DOS

IR

Vibrations