Geometry & MOs

Info

ID:	331340
PubChem CID:	127248747
Reduced:	O3N5C24H33 (1)
Stoich.:	A3B5C24D33 (1)
Weight, g/mol:	415.238353
ΔH_f, kcal/mol:	-62.79
Dipole, Da:	3.13
IP(EA), eV:	-8.31(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[2-(dimethylamino)-5-(4-fluorophenyl)pyrimidin-4-yl]morpholin-4-yl]-N,N-diethylacetamide

Drug info:

PubChemData

Smile

CN(C)C1=NC=C(C(=N1)C2CN(CCO2)CC(=O)N3CCCCC3)C4=CC=C(C=C4)OC

DOS

IR

Vibrations