Geometry & MOs

Info

ID:	332414
PubChem CID:	127250700
Reduced:	O3N5C24H29 (1)
Stoich.:	A3B5C24D29 (1)
Weight, g/mol:	436.211055
ΔH_f, kcal/mol:	-20.9
Dipole, Da:	4.1
IP(EA), eV:	-8.83(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-methoxyphenoxy)-2-methyl-1-[2-[6-(1-methylpyrazol-4-yl)pyridin-2-yl]morpholin-4-yl]propan-1-one

Drug info:

PubChemData

Smile

CN1C=C(C=N1)C2=NC(=CC=C2)C3CN(CCO3)C(=O)C4=CC=CC=C4OCCN(C)C

DOS

IR

Vibrations