Geometry & MOs

Info

ID:	121278
PubChem CID:	50761482
Reduced:	SN3O3H17C19 (1)
Stoich.:	AB3C3D17E19 (1)
Weight, g/mol:	339.104148
ΔH_f, kcal/mol:	-46.25
Dipole, Da:	6.64
IP(EA), eV:	-8.55(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-amino-2-(2-methylanilino)-1,3-thiazol-5-yl]-(2-methoxyphenyl)methanone

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(=O)C2=C(N=C(S2)NC3=CC=CC(=C3)C(=O)OC)N

DOS

IR

Vibrations