Geometry & MOs

Info

ID:	237034
PubChem CID:	92717030
Reduced:	FNO2C26H28 (1)
Stoich.:	ABC2D26E28 (1)
Weight, g/mol:	355.135448
ΔH_f, kcal/mol:	-70.08
Dipole, Da:	0.89
IP(EA), eV:	-8.88(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R)-1-(2-methoxyphenyl)ethyl]-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]acetamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)[C@](C2=CC=C(C=C2)F)([C@@H](CN3CCOCC3)C4=CC=CC=C4)O

DOS

IR

Vibrations