Geometry & MOs

Info

ID:	290313
PubChem CID:	104426992
Reduced:	O2N5C14H21 (1)
Stoich.:	A2B5C14D21 (1)
Weight, g/mol:	274.179361
ΔH_f, kcal/mol:	-54.17
Dipole, Da:	4.22
IP(EA), eV:	-8.47(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-amino-7-methylbenzimidazol-1-yl)-N-tert-butylpropanamide

Drug info:

PubChemData

Smile

CC(C)(C)NC(=O)CCN1C2=C(C=CC(=N2)OC)N=C1N

DOS

IR

Vibrations