Geometry & MOs

Info

ID:	266718
PubChem CID:	103579182
Reduced:	NOF2C12H17 (1)
Stoich.:	ABC2D12E17 (1)
Weight, g/mol:	239.105862
ΔH_f, kcal/mol:	-130.55
Dipole, Da:	4.51
IP(EA), eV:	-10.07(0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-pent-1-yn-3-ylquinoxaline-6-carboxamide

Drug info:

PubChemData

Smile

CCC(C#C)NC(=O)C1CCC(CC1)(F)F

DOS

IR

Vibrations