Geometry & MOs

Info

ID:	128982
PubChem CID:	51065040
Reduced:	ClO2S2N4H17C22 (1)
Stoich.:	AB2C2D4E17F22 (1)
Weight, g/mol:	380.119464
ΔH_f, kcal/mol:	79.43
Dipole, Da:	2.67
IP(EA), eV:	-8.56(-1.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-(4-methylphenyl)sulfanyl-2-phenyl-1,3-oxazol-4-yl]-morpholin-4-ylmethanone

Drug info:

PubChemData

Smile

CC1=NOC(=C1C(=O)NC2=NN=C(S2)SC/C=C/C3=CC=CC=C3)C4=CC=C(C=C4)Cl

DOS

IR

Vibrations