Geometry & MOs

Info

ID:	266679
PubChem CID:	103578964
Reduced:	NO2C8H13 (1)
Stoich.:	AB2C8D13 (1)
Weight, g/mol:	195.125929
ΔH_f, kcal/mol:	-55.57
Dipole, Da:	3.27
IP(EA), eV:	-9.99(0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-pent-1-yn-3-yloxane-2-carboxamide

Drug info:

PubChemData

Smile

CCC(C#C)NC(=O)COC

DOS

IR

Vibrations