Geometry & MOs

Info

ID:	131521
PubChem CID:	51220160
Reduced:	SN3O3C19H19 (1)
Stoich.:	AB3C3D19E19 (1)
Weight, g/mol:	311.109233
ΔH_f, kcal/mol:	-89.25
Dipole, Da:	6.49
IP(EA), eV:	-8.99(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-[(1-ethylbenzimidazol-2-yl)methyl]-3-thiophen-3-ylprop-2-enamide

Drug info:

PubChemData

Smile

CCNC(=O)C1=CC(=CC=C1)NC(=O)CC2C(=O)NC3=CC=CC=C3S2

DOS

IR

Vibrations