Geometry & MOs

Info

ID:	333643
PubChem CID:	127252195
Reduced:	ON5C27H31 (1)
Stoich.:	AB5C27D31 (1)
Weight, g/mol:	350.154289
ΔH_f, kcal/mol:	25.69
Dipole, Da:	4.73
IP(EA), eV:	-9.1(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C2CCC(=O)N(C2=NC(=N1)C3CCN(C3)CC4=CN=CC=C4)CCCC5=CC=CC=C5

DOS

IR

Vibrations