Geometry & MOs

Info

ID:	126584
PubChem CID:	50968886
Reduced:	OF3N5C16H22 (1)
Stoich.:	AB3C5D16E22 (1)
Weight, g/mol:	370.083268
ΔH_f, kcal/mol:	-175.58
Dipole, Da:	7.36
IP(EA), eV:	-9.01(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(6-chloro-1H-benzimidazol-2-yl)methyl]-N-methyl-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide

Drug info:

PubChemData

Smile

CC1=CC(=NC(=N1)CCNC(=O)[C@@]23CNC[C@@H]2CN(C3)C)C(F)(F)F

DOS

IR

Vibrations