Geometry & MOs

Info

ID:	193332
PubChem CID:	78376464
Reduced:	ClNO5C29H32 (1)
Stoich.:	ABC5D29E32 (1)
Weight, g/mol:	285.195346
ΔH_f, kcal/mol:	-158.04
Dipole, Da:	1.28
IP(EA), eV:	-8.42(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-butyl-4-imidazol-1-yl-N-phenylpyrazolidin-3-amine

Drug info:

PubChemData

Smile

CCCOC1=C(C=C(C=C1)C2C3=C(C(=O)N2CCC4=CC=CC=C4)OC5CCC(CC5C3=O)Cl)OC

DOS

IR

Vibrations