Geometry & MOs

Info

ID:	331341
PubChem CID:	127248748
Reduced:	FO2N5C22H30 (1)
Stoich.:	AB2C5D22E30 (1)
Weight, g/mol:	415.238353
ΔH_f, kcal/mol:	-78.21
Dipole, Da:	5.93
IP(EA), eV:	-8.76(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[2-(dimethylamino)-5-(3-fluorophenyl)pyrimidin-4-yl]morpholin-4-yl]-N,N-diethylacetamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CN1CCOC(C1)C2=NC(=NC=C2C3=CC=C(C=C3)F)N(C)C

DOS

IR

Vibrations