Geometry & MOs

Info

ID:	80752
PubChem CID:	49836649
Reduced:	N4H14C17 (2)
Stoich.:	A4B14C17 (2)
Weight, g/mol:	179.075785
ΔH_f, kcal/mol:	235.62
Dipole, Da:	5.68
IP(EA), eV:	-8.48(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,4-difluoro-N-hydroxycyclohexane-1-carboxamide

Drug info:

PubChemData

Smile

CN1C[C@@H]2C[C@H]1CN2C3=CC=C(C4=CC=CC=C43)C5=CC=NC6=C(C(=NN56)C7=CC=NC=C7)C8=C9C=NNC9=CC=C8

DOS

IR

Vibrations