Geometry & MOs

Info

ID:	61146
PubChem CID:	26706118
Reduced:	SN3O3H21C22 (1)
Stoich.:	AB3C3D21E22 (1)
Weight, g/mol:	382.098728
ΔH_f, kcal/mol:	-18.11
Dipole, Da:	1.5
IP(EA), eV:	-8.25(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-2,3-dihydro-1-benzofuran-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC2=CC=CC=C2N1CC(=O)NC3=NC(=CS3)C4=C(C=CC(=C4)OC)OC

DOS

IR

Vibrations