Geometry & MOs

Info

ID:	266703
PubChem CID:	103579139
Reduced:	ClNOSC10H10 (1)
Stoich.:	ABCDE10F10 (1)
Weight, g/mol:	217.110279
ΔH_f, kcal/mol:	17.68
Dipole, Da:	3.03
IP(EA), eV:	-9.68(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-pent-1-yn-3-yl-2-phenoxyacetamide

Drug info:

PubChemData

Smile

CCC(C#C)NC(=O)C1=CC=C(S1)Cl

DOS

IR

Vibrations