Geometry & MOs

Info

ID:	256534
PubChem CID:	103139751
Reduced:	ON2H16C17 (1)
Stoich.:	AB2C16D17 (1)
Weight, g/mol:	217.123342
ΔH_f, kcal/mol:	28.25
Dipole, Da:	3.92
IP(EA), eV:	-8.51(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(chloromethyl)-1-[(5-methyloxolan-2-yl)methyl]pyrrolidine

Drug info:

PubChemData

Smile

CCC1=CC(=CC=C1)OC2=C3C=NC=CC3=C(C=C2)N

DOS

IR

Vibrations