Geometry & MOs

Info

ID:	240030
PubChem CID:	93575844
Reduced:	FO2N4C21H23 (1)
Stoich.:	AB2C4D21E23 (1)
Weight, g/mol:	378.205576
ΔH_f, kcal/mol:	-88.04
Dipole, Da:	6.21
IP(EA), eV:	-9.0(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-[(1R)-1-[1-[2-(4-methylanilino)-2-oxoethyl]benzimidazol-2-yl]ethyl]propanamide

Drug info:

PubChemData

Smile

C[C@@H](C1=NC2=CC=CC=C2N1CC(=O)NC3=CC(=CC=C3)F)NC(=O)C(C)C

DOS

IR

Vibrations