Geometry & MOs

Info

ID:	183580
PubChem CID:	77042515
Reduced:	ON7C12H17 (1)
Stoich.:	AB7C12D17 (1)
Weight, g/mol:	223.100857
ΔH_f, kcal/mol:	118.1
Dipole, Da:	9.19
IP(EA), eV:	-7.87(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-fluoro-4-hydroxyphenyl)-2-methylpent-2-enamide

Drug info:

PubChemData

Smile

C1CCC(C1)N2C=CC(=N2)CN3C=NC(=C(N)N=O)N3

DOS

IR

Vibrations