Geometry & MOs

Info

ID:	332698
PubChem CID:	127250984
Reduced:	N2O2C12H13 (2)
Stoich.:	A2B2C12D13 (2)
Weight, g/mol:	422.175419
ΔH_f, kcal/mol:	-62.38
Dipole, Da:	6.52
IP(EA), eV:	-8.48(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-fluorophenyl)-2-[2-[6-(3-methoxyphenyl)pyrazin-2-yl]morpholin-4-yl]acetamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2=CN=CC(=N2)C3CN(CCO3)CC(=O)NC4=CC=C(C=C4)OC

DOS

IR

Vibrations