Geometry & MOs

Info

ID:	145495
PubChem CID:	53535533
Reduced:	NO3C26H27 (1)
Stoich.:	AB3C26D27 (1)
Weight, g/mol:	387.107519
ΔH_f, kcal/mol:	-64.22
Dipole, Da:	5.46
IP(EA), eV:	-8.32(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanylmethyl]-1,3-thiazol-2-yl]-N-(2-ethylphenyl)acetamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)NC(=O)C2(CCOCC2)C3=CC=CC=C3)CC4=CC=CC=C4

DOS

IR

Vibrations