Geometry & MOs

Info

ID:	266763
PubChem CID:	103579319
Reduced:	NOC14H15 (1)
Stoich.:	ABC14D15 (1)
Weight, g/mol:	237.09652
ΔH_f, kcal/mol:	34.36
Dipole, Da:	3.26
IP(EA), eV:	-9.56(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,4-difluorophenyl)-N-pent-1-yn-3-ylacetamide

Drug info:

PubChemData

Smile

CCC(C#C)NC(=O)C1CC2=CC=CC=C12

DOS

IR

Vibrations