Geometry & MOs

Info

ID:	227882
PubChem CID:	87562844
Reduced:	FNO2H14C15 (1)
Stoich.:	ABC2D14E15 (1)
Weight, g/mol:	488.20597
ΔH_f, kcal/mol:	-31.95
Dipole, Da:	5.0
IP(EA), eV:	-8.74(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-hydroxy-2-(2-methoxyethoxy)-6-[4-[2-[4-(morpholin-4-ylmethyl)phenyl]ethynyl]phenyl]pyrimidine-4-carboxamide

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)/C=[N+](\C2=CC=C(C=C2)F)/[O-]

DOS

IR

Vibrations