Geometry & MOs

Info

ID:	176130
PubChem CID:	75999537
Reduced:	SO2N6C19H24 (1)
Stoich.:	AB2C6D19E24 (1)
Weight, g/mol:	325.19026
ΔH_f, kcal/mol:	62.37
Dipole, Da:	13.53
IP(EA), eV:	-8.76(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-5-anilino-N-(4-ethylphenyl)pyrazolidine-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)CC1=NC(=C(C=C1)C#N)SCC(=NC2=C[N+](=NO2)N3CCCCC3)[O-]

DOS

IR

Vibrations