Geometry & MOs

Info

ID:	29978
PubChem CID:	838712
Reduced:	O2C6H7 (2)
Stoich.:	A2B6C7 (2)
Weight, g/mol:	276.093249
ΔH_f, kcal/mol:	-118.07
Dipole, Da:	3.04
IP(EA), eV:	-8.76(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]butanamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1O/C(=C/OC)/C(=O)OC

DOS

IR

Vibrations