Geometry & MOs

Info

ID:	400083
PubChem CID:	135045172
Reduced:	NSO2C16H25 (1)
Stoich.:	ABC2D16E25 (1)
Weight, g/mol:	293.072179
ΔH_f, kcal/mol:	-58.51
Dipole, Da:	1.99
IP(EA), eV:	-8.81(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 5-[(3-methoxyphenyl)methoxy]-1,3-thiazole-4-carboxylate

Drug info:

PubChemData

Smile

CCCSC/C(=N\O)/C(CC(C)(C)O)C1=CC=CC=C1

DOS

IR

Vibrations