Geometry & MOs

Info

ID:	391396
PubChem CID:	135004712
Reduced:	ClNO2F3H5C10 (1)
Stoich.:	ABC2D3E5F10 (1)
Weight, g/mol:	343.225977
ΔH_f, kcal/mol:	-212.82
Dipole, Da:	4.53
IP(EA), eV:	-9.78(-1.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[(1R)-1-(1-benzyl-4-methylimidazol-2-yl)-2-methylpropyl]carbamate

Drug info:

PubChemData

Smile

C1=CC(=C2C=C(NC2=C1C(F)(F)F)C(=O)O)Cl

DOS

IR

Vibrations