Geometry & MOs

Info

ID:	151131
PubChem CID:	53790829
Reduced:	O2C13H14 (1)
Stoich.:	A2B13C14 (1)
Weight, g/mol:	141.096109
ΔH_f, kcal/mol:	-78.72
Dipole, Da:	4.51
IP(EA), eV:	-9.47(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(oxoboranylmethyl)pyrrolidin-3-yl]methanol

Drug info:

PubChemData

Smile

CC1=C(C(=C2C(=O)CC(=O)C2=C1C)C)C

DOS

IR

Vibrations