Geometry & MOs

Info

ID:	385348
PubChem CID:	134978834
Reduced:	BO2C10H11 (1)
Stoich.:	AB2C10D11 (1)
Weight, g/mol:	199.1361
ΔH_f, kcal/mol:	-109.37
Dipole, Da:	1.45
IP(EA), eV:	-8.96(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-2-(2-phenylethynyl)pyrrolidine

Drug info:

PubChemData

Smile

B1(OC2=CC=CC=C2O1)C=C(C)C

DOS

IR

Vibrations