Geometry & MOs

Info

ID:	326897
PubChem CID:	126688598
Reduced:	F2N4O5C23H24 (1)
Stoich.:	A2B4C5D23E24 (1)
Weight, g/mol:	474.171476
ΔH_f, kcal/mol:	-241.36
Dipole, Da:	3.66
IP(EA), eV:	-9.1(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(difluoromethoxy)-N-[1-(4-hydroxybutan-2-yl)-5-(3-oxomorpholin-4-yl)benzimidazol-2-yl]benzamide

Drug info:

PubChemData

Smile

C[C@H](CCO)N1C2=C(C=C(C=C2)N3CCOCC3=O)N=C1NC(=O)C4=CC(=CC=C4)OC(F)F

DOS

IR

Vibrations