Geometry & MOs

Info

ID:	154439
PubChem CID:	56313878
Reduced:	SN2F3O5C17H19 (1)
Stoich.:	AB2C3D5E17F19 (1)
Weight, g/mol:	383.19574
ΔH_f, kcal/mol:	-348.72
Dipole, Da:	2.56
IP(EA), eV:	-9.02(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[2-(morpholin-4-ylmethyl)-3H-benzimidazol-5-yl]propanamide

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)CCC(=O)NCCN2C(=O)CSC2=O)OCC(F)(F)F

DOS

IR

Vibrations