Geometry & MOs

Info

ID:	326847
PubChem CID:	126688402
Reduced:	F3N4O4C25H25 (1)
Stoich.:	A3B4C4D25E25 (1)
Weight, g/mol:	501.201219
ΔH_f, kcal/mol:	-251.04
Dipole, Da:	4.0
IP(EA), eV:	-8.71(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(3-hydroxypropyl)-5-(3-oxomorpholin-4-yl)benzimidazol-2-yl]-3-(1-methyl-2-oxopyridin-4-yl)benzamide

Drug info:

PubChemData

Smile

C1CN(C(=O)OC1)C2=CC3=C(C=C2)N(C(=N3)NC(=O)C4=CC=CC(=C4)C(F)F)CC5(CCOCC5)F

DOS

IR

Vibrations