Geometry & MOs

Info

ID:	331684
PubChem CID:	127249767
Reduced:	FO3N4C25H25 (1)
Stoich.:	AB3C4D25E25 (1)
Weight, g/mol:	447.22704
ΔH_f, kcal/mol:	-57.33
Dipole, Da:	1.37
IP(EA), eV:	-8.11(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,5-dimethylpyrazol-3-yl)-6-[4-[(6-methoxy-2H-chromen-3-yl)methyl]morpholin-2-yl]pyridin-2-amine

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)OCC(=C2)CN3CCOC(C3)C4=NC(=CC=C4)NC5=NC=C(C=C5)F

DOS

IR

Vibrations