Geometry & MOs

Info

ID:	242658
PubChem CID:	97857771
Reduced:	SO2N4C16H24 (1)
Stoich.:	AB2C4D16E24 (1)
Weight, g/mol:	294.137971
ΔH_f, kcal/mol:	-74.72
Dipole, Da:	1.52
IP(EA), eV:	-8.74(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[(2R)-4-cyclopropylmorpholin-2-yl]methyl]-2-fluoro-4-hydroxybenzamide

Drug info:

PubChemData

Smile

CC1=C(SC2=NC(=NC(=C12)N)C)C(=O)NC[C@H](C(C)(C)C)OC

DOS

IR

Vibrations