Geometry & MOs

Info

ID:	266717
PubChem CID:	103579180
Reduced:	NO2C11H17 (1)
Stoich.:	AB2C11D17 (1)
Weight, g/mol:	229.127821
ΔH_f, kcal/mol:	-54.9
Dipole, Da:	3.23
IP(EA), eV:	-9.78(1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,4-difluoro-N-pent-1-yn-3-ylcyclohexane-1-carboxamide

Drug info:

PubChemData

Smile

CCC(C#C)NC(=O)C1C(CCO1)C

DOS

IR

Vibrations