Geometry & MOs

Info

ID:	292570
PubChem CID:	116933605
Reduced:	N2C6H9 (2)
Stoich.:	A2B6C9 (2)
Weight, g/mol:	232.168797
ΔH_f, kcal/mol:	29.69
Dipole, Da:	3.53
IP(EA), eV:	-9.11(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-1-(2-methyl-3H-benzimidazol-5-yl)butane-1,3-diamine

Drug info:

PubChemData

Smile

CC(C)(CC(C1=CC2=C(C=C1)N=CN2)N)N

DOS

IR

Vibrations