Geometry & MOs

Info

ID:	126383
PubChem CID:	50962947
Reduced:	N2O3C19H22 (1)
Stoich.:	A2B3C19D22 (1)
Weight, g/mol:	383.17461
ΔH_f, kcal/mol:	-108.39
Dipole, Da:	6.61
IP(EA), eV:	-8.69(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[3-(2-imidazol-1-ylpropyl)-5-phenylimidazol-4-yl]-3-methyl-1,2-benzoxazole

Drug info:

PubChemData

Smile

CC1CC2=C(O1)C=CC(=C2)CNC(=O)C3=C(NC(=C3C)C(=O)C)C

DOS

IR

Vibrations