Geometry & MOs

Info

ID:	329494
PubChem CID:	126737510
Reduced:	SN2C14H14 (1)
Stoich.:	AB2C14D14 (1)
Weight, g/mol:	569.190832
ΔH_f, kcal/mol:	77.36
Dipole, Da:	1.32
IP(EA), eV:	-8.59(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(difluoromethyl)-N-[5-[[2-(2-methoxyethoxy)ethylamino]methyl]-1-[3-(prop-2-enoylamino)phenyl]benzimidazol-2-yl]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=C(C=C2)C/C=N/SN

DOS

IR

Vibrations