Geometry & MOs

Info

ID:	255852
PubChem CID:	103135206
Reduced:	O3C15H22 (1)
Stoich.:	A3B15C22 (1)
Weight, g/mol:	283.179696
ΔH_f, kcal/mol:	-137.71
Dipole, Da:	3.82
IP(EA), eV:	-8.7(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(benzimidazol-1-yl)-1-(1-methylpyrazol-3-yl)ethyl]propan-1-amine

Drug info:

PubChemData

Smile

CC1CCC(O1)COC2=C(C=C(C=C2)[C@@H](C)O)C

DOS

IR

Vibrations