Geometry & MOs

Info

ID:	205843
PubChem CID:	80165013
Reduced:	ON5C13H19 (1)
Stoich.:	AB5C13D19 (1)
Weight, g/mol:	248.127326
ΔH_f, kcal/mol:	-11.02
Dipole, Da:	3.92
IP(EA), eV:	-7.88(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-(1,4-dioxan-2-ylmethyl)-3H-benzimidazole-2,5-diamine

Drug info:

PubChemData

Smile

CC(C)NC(=O)CN(C)C1=NC2=C(N1)C=C(C=C2)N

DOS

IR

Vibrations