Geometry & MOs

Info

ID:	216399
PubChem CID:	85086163
Reduced:	ON3C16H17 (1)
Stoich.:	AB3C16D17 (1)
Weight, g/mol:	263.132157
ΔH_f, kcal/mol:	40.21
Dipole, Da:	2.93
IP(EA), eV:	-8.65(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[cyclohexyl(hydroxy)amino]-1-(4-fluorophenyl)prop-2-en-1-one

Drug info:

PubChemData

Smile

C1COC2=C1C=C(C=C2)C3CNNC3C4=CC=CC=N4

DOS

IR

Vibrations