Geometry & MOs

Info

ID:	367058
PubChem CID:	127323043
Reduced:	O2N3C20H21 (1)
Stoich.:	A2B3C20D21 (1)
Weight, g/mol:	332.163711
ΔH_f, kcal/mol:	-21.75
Dipole, Da:	3.67
IP(EA), eV:	-8.69(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-5-methyl-1,3-benzoxazole

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)OC(=N2)N3CCCC(C3)C(=O)NC4=CC=CC=C4

DOS

IR

Vibrations