Geometry & MOs

Info

ID:	247478
PubChem CID:	103071739
Reduced:	ON2C13H22 (1)
Stoich.:	AB2C13D22 (1)
Weight, g/mol:	257.189198
ΔH_f, kcal/mol:	-30.26
Dipole, Da:	5.29
IP(EA), eV:	-8.65(0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5,6-dimethylbenzimidazol-1-yl)methyl]-N-propan-2-ylprop-2-en-1-amine

Drug info:

PubChemData

Smile

C=C(CNC1CC1)CN2CCCCCC2=O

DOS

IR

Vibrations