Geometry & MOs

Info

ID:	61589
PubChem CID:	26710799
Reduced:	N3O3S3H17C21 (1)
Stoich.:	A3B3C3D17E21 (1)
Weight, g/mol:	396.107854
ΔH_f, kcal/mol:	-18.05
Dipole, Da:	6.12
IP(EA), eV:	-8.8(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-ethylbenzimidazol-1-yl)-N-[[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]methyl]acetamide

Drug info:

PubChemData

Smile

CC1=NC(=CS1)C2=CC=C(S2)CNC(=O)CN3C4=CC=CC5=C4C(=CC=C5)S3(=O)=O

DOS

IR

Vibrations