Geometry & MOs

Info

ID:	441020
PubChem CID:	135232726
Reduced:	NC4H5 (3)
Stoich.:	AB4C5 (3)
Weight, g/mol:	227.142248
ΔH_f, kcal/mol:	48.68
Dipole, Da:	1.92
IP(EA), eV:	-8.76(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-ethenyl-3-propylphenyl)pyrazol-3-amine

Drug info:

PubChemData

Smile

CCC1CC=C(C=C1)C2=NC=CC(=N2)N

DOS

IR

Vibrations