Geometry & MOs

Info

ID:	326825
PubChem CID:	126688297
Reduced:	FN4O4C22H23 (1)
Stoich.:	AB4C4D22E23 (1)
Weight, g/mol:	323.184506
ΔH_f, kcal/mol:	-140.97
Dipole, Da:	3.7
IP(EA), eV:	-8.65(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[5-amino-4-(3-hydroxypropylamino)-2-propan-2-yloxyphenyl]morpholin-3-one

Drug info:

PubChemData

Smile

C1COCC(=O)N1C2=CC3=C(C=C2)N(C(=N3)NC(=O)C4=CC=CC(=C4)CF)CCCO

DOS

IR

Vibrations