Geometry & MOs

Info

ID:	28254
PubChem CID:	826556
Reduced:	NOC19H19 (1)
Stoich.:	ABC19D19 (1)
Weight, g/mol:	349.11365
ΔH_f, kcal/mol:	14.02
Dipole, Da:	1.46
IP(EA), eV:	-8.29(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

morpholin-4-yl-(2-naphthalen-1-ylsulfanylphenyl)methanone

Drug info:

PubChemData

Smile

CC1(C2=CC=CC=C2N([C@@]13C=CC4=CC=CC=C4O3)C)C

DOS

IR

Vibrations