Geometry & MOs

Info

ID:	333023
PubChem CID:	127251447
Reduced:	NOC12H15 (2)
Stoich.:	ABC12D15 (2)
Weight, g/mol:	398.176106
ΔH_f, kcal/mol:	-66.61
Dipole, Da:	3.75
IP(EA), eV:	-9.21(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[4-[(3-chlorophenyl)methyl]-6-methylpyridin-2-yl]morpholin-4-yl]-cyclopentylmethanone

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CC2=CC(=NC(=C2)C)C3CN(CCO3)C(=O)C4CCCC4

DOS

IR

Vibrations