Geometry & MOs

Info

ID:	173060
PubChem CID:	75591364
Reduced:	N3O3C19H27 (1)
Stoich.:	A3B3C19D27 (1)
Weight, g/mol:	382.179361
ΔH_f, kcal/mol:	-96.61
Dipole, Da:	4.58
IP(EA), eV:	-8.69(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-phenyl-5-(1-prop-2-enylpyrazol-4-yl)imidazol-1-yl]-2,3-dihydro-1H-inden-2-ol

Drug info:

PubChemData

Smile

C1CCN(C1)C2COCC2NC(=O)C3=CC=CC=C3N4CCOCC4

DOS

IR

Vibrations