Geometry & MOs

Info

ID:	155146
PubChem CID:	56320811
Reduced:	SN4O4C21H24 (1)
Stoich.:	AB4C4D21E24 (1)
Weight, g/mol:	467.187878
ΔH_f, kcal/mol:	-71.29
Dipole, Da:	7.48
IP(EA), eV:	-8.99(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-N-[1-[2-[2-(4-methylphenyl)-1,3-oxazol-4-yl]ethylamino]-4-methylsulfanyl-1-oxobutan-2-yl]benzamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=NC(=CO2)CCNC(=O)CSC(C)C(=O)NC3=NOC(=C3)C

DOS

IR

Vibrations