Geometry & MOs

Info

ID:	266680
PubChem CID:	103578991
Reduced:	NO2C11H17 (1)
Stoich.:	AB2C11D17 (1)
Weight, g/mol:	223.08087
ΔH_f, kcal/mol:	-68.43
Dipole, Da:	2.28
IP(EA), eV:	-9.78(0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5-difluoro-N-pent-1-yn-3-ylbenzamide

Drug info:

PubChemData

Smile

CCC(C#C)NC(=O)C1CCCCO1

DOS

IR

Vibrations