Geometry & MOs

Info

ID:	264502
PubChem CID:	103464808
Reduced:	ClN2O2C16H17 (1)
Stoich.:	AB2C2D16E17 (1)
Weight, g/mol:	285.145282
ΔH_f, kcal/mol:	-37.57
Dipole, Da:	3.25
IP(EA), eV:	-9.29(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,2-dimethylbutyl)-2-(trifluoromethyl)benzimidazol-5-amine

Drug info:

PubChemData

Smile

COCC(C1=CC=CC=C1)(C(=O)N)NC2=CC=CC=C2Cl

DOS

IR

Vibrations