Geometry & MOs

Info

ID:	332707
PubChem CID:	127250993
Reduced:	SN4O4C19H26 (1)
Stoich.:	AB4C4D19E26 (1)
Weight, g/mol:	395.220892
ΔH_f, kcal/mol:	-101.48
Dipole, Da:	4.12
IP(EA), eV:	-9.05(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclopentyl-1-[2-[6-(3-methoxyphenyl)pyrazin-2-yl]morpholin-4-yl]propan-1-one

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations