Geometry & MOs

Info

ID:	273113
PubChem CID:	103770521
Reduced:	NF2O3C8H15 (1)
Stoich.:	AB2C3D8E15 (1)
Weight, g/mol:	289.11012
ΔH_f, kcal/mol:	-250.96
Dipole, Da:	7.07
IP(EA), eV:	-9.98(0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,3-difluoro-2-hydroxypropyl)-3-(trifluoromethyl)cyclohexane-1-carboxamide

Drug info:

PubChemData

Smile

COCCCC(=O)NCC(C(F)F)O

DOS

IR

Vibrations