Geometry & MOs

Info

ID:	201997
PubChem CID:	79615329
Reduced:	N2O3C14H22 (1)
Stoich.:	A2B3C14D22 (1)
Weight, g/mol:	342.05791
ΔH_f, kcal/mol:	-128.4
Dipole, Da:	6.8
IP(EA), eV:	-9.18(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(4-bromo-1-ethylpyrrole-2-carbonyl)piperidin-4-yl]acetic acid

Drug info:

PubChemData

Smile

C=CCN(CC(=O)O)C(=O)CC1CC2CCC(C1)N2

DOS

IR

Vibrations