Geometry & MOs

Info

ID:	266739
PubChem CID:	103579254
Reduced:	ClNOC13H14 (1)
Stoich.:	ABCD13E14 (1)
Weight, g/mol:	181.110279
ΔH_f, kcal/mol:	7.84
Dipole, Da:	2.68
IP(EA), eV:	-9.69(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC(C#C)NC(=O)CC1=CC=CC=C1Cl

DOS

IR

Vibrations