Geometry & MOs

Info

ID:	182746
PubChem CID:	76934395
Reduced:	SBr2N2O3H8C10 (1)
Stoich.:	AB2C2D3E8F10 (1)
Weight, g/mol:	236.116092
ΔH_f, kcal/mol:	-53.81
Dipole, Da:	2.12
IP(EA), eV:	-9.34(-1.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methoxycyclopentyl)-6-oxo-3H-pyridine-3-carboxamide

Drug info:

PubChemData

Smile

C1=C(OC(=C1Br)Br)C=C2C(=O)N(C(=O)S2)CCN

DOS

IR

Vibrations