Geometry & MOs

Info

ID:	332702
PubChem CID:	127250988
Reduced:	NOC6H7 (3)
Stoich.:	ABC6D7 (3)
Weight, g/mol:	313.15904
ΔH_f, kcal/mol:	-62.82
Dipole, Da:	4.51
IP(EA), eV:	-8.93(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(cyclopropylmethyl)-2-[6-(2-fluorophenyl)pyrazin-2-yl]morpholine

Drug info:

PubChemData

Smile

CCC(=O)N1CCOC(C1)C2=NC(=CN=C2)C3=CC(=CC=C3)OC

DOS

IR

Vibrations