Geometry & MOs

Info

ID:	332779
PubChem CID:	127251089
Reduced:	O2N6C25H32 (1)
Stoich.:	A2B6C25D32 (1)
Weight, g/mol:	367.149619
ΔH_f, kcal/mol:	12.02
Dipole, Da:	5.17
IP(EA), eV:	-8.52(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(4-fluorophenyl)methyl]-2-[3-(3-fluorophenyl)pyrazin-2-yl]morpholine

Drug info:

PubChemData

Smile

CC(C)(C1=CC=C(C=C1)OC)C(=O)N2CCC(C2)C3=NC(=NC=C3C4=CN(N=C4)C)N(C)C

DOS

IR

Vibrations