Geometry & MOs

Info

ID:	331913
PubChem CID:	127250199
Reduced:	O3N5C24H27 (1)
Stoich.:	A3B5C24D27 (1)
Weight, g/mol:	449.206304
ΔH_f, kcal/mol:	-44.11
Dipole, Da:	4.81
IP(EA), eV:	-8.81(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-amino-4-methylpyrimidin-5-yl)-[2-[5-[(2,5-dimethoxyphenyl)methyl]pyridin-2-yl]morpholin-4-yl]methanone

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1CC2=CN=C(C=C2)C3CN(CCO3)C(=O)C4=CN=C(N=C4C)N

DOS

IR

Vibrations